Linear 1 3-diarylpropanoids
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Filtered Search Results
2'-Hydroxy-3-phenylpropiophenone 98.0+%, TCI America™
CAS: 3516-95-8 Molecular Formula: C15H14O2 Molecular Weight (g/mol): 226.275 MDL Number: MFCD00002221 InChI Key: JCPGMXJLFWGRMZ-UHFFFAOYSA-N Synonym: 2-Hydroxyphenyl Phenethyl Ketone, 2-Hydroxyphenyl 2-Phenylethyl Ketone PubChem CID: 77052 IUPAC Name: 1-(2-hydroxyphenyl)-3-phenylpropan-1-one SMILES: C1=CC=C(C=C1)CCC(=O)C2=CC=CC=C2O
| PubChem CID | 77052 |
|---|---|
| CAS | 3516-95-8 |
| Molecular Weight (g/mol) | 226.275 |
| MDL Number | MFCD00002221 |
| SMILES | C1=CC=C(C=C1)CCC(=O)C2=CC=CC=C2O |
| Synonym | 2-Hydroxyphenyl Phenethyl Ketone, 2-Hydroxyphenyl 2-Phenylethyl Ketone |
| IUPAC Name | 1-(2-hydroxyphenyl)-3-phenylpropan-1-one |
| InChI Key | JCPGMXJLFWGRMZ-UHFFFAOYSA-N |
| Molecular Formula | C15H14O2 |
2'-Hydroxy-2-methoxychalcone 98.0+%, TCI America™
CAS: 42220-77-9 Molecular Formula: C16H14O3 Molecular Weight (g/mol): 254.285 MDL Number: MFCD00016443 InChI Key: SNTIPKTZVAKPOX-ZHACJKMWSA-N Synonym: 2-(2-Methoxybenzylidene)-2′C-hydroxyacetophenone PubChem CID: 5709142 IUPAC Name: (E)-1-(2-hydroxyphenyl)-3-(2-methoxyphenyl)prop-2-en-1-one SMILES: COC1=CC=CC=C1C=CC(=O)C2=CC=CC=C2O
| PubChem CID | 5709142 |
|---|---|
| CAS | 42220-77-9 |
| Molecular Weight (g/mol) | 254.285 |
| MDL Number | MFCD00016443 |
| SMILES | COC1=CC=CC=C1C=CC(=O)C2=CC=CC=C2O |
| Synonym | 2-(2-Methoxybenzylidene)-2′C-hydroxyacetophenone |
| IUPAC Name | (E)-1-(2-hydroxyphenyl)-3-(2-methoxyphenyl)prop-2-en-1-one |
| InChI Key | SNTIPKTZVAKPOX-ZHACJKMWSA-N |
| Molecular Formula | C16H14O3 |
2'-Hydroxy-4,4',6'-trimethoxychalcone 98.0+%, TCI America™
CAS: 3420-72-2 Molecular Formula: C18H18O5 Molecular Weight (g/mol): 314.337 MDL Number: MFCD00017174 InChI Key: CGIBCVBDFUTMPT-RMKNXTFCSA-N Synonym: Flavokawain A PubChem CID: 5355469 IUPAC Name: (E)-1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one SMILES: COC1=CC=C(C=C1)C=CC(=O)C2=C(C=C(C=C2OC)OC)O
| PubChem CID | 5355469 |
|---|---|
| CAS | 3420-72-2 |
| Molecular Weight (g/mol) | 314.337 |
| MDL Number | MFCD00017174 |
| SMILES | COC1=CC=C(C=C1)C=CC(=O)C2=C(C=C(C=C2OC)OC)O |
| Synonym | Flavokawain A |
| IUPAC Name | (E)-1-(2-hydroxy-4,6-dimethoxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one |
| InChI Key | CGIBCVBDFUTMPT-RMKNXTFCSA-N |
| Molecular Formula | C18H18O5 |
2,2-Dibromo-1,3-diphenyl-1,3-propanedione 98.0+%, TCI America™
CAS: 16619-55-9 Molecular Formula: C15H10Br2O2 Molecular Weight (g/mol): 382.05 MDL Number: MFCD00068642 InChI Key: GSWSUDFFJVJMLG-UHFFFAOYSA-N Synonym: Dibenzoyldibromomethane PubChem CID: 12356677 IUPAC Name: 2,2-dibromo-1,3-diphenylpropane-1,3-dione SMILES: BrC(Br)(C(=O)C1=CC=CC=C1)C(=O)C1=CC=CC=C1
| PubChem CID | 12356677 |
|---|---|
| CAS | 16619-55-9 |
| Molecular Weight (g/mol) | 382.05 |
| MDL Number | MFCD00068642 |
| SMILES | BrC(Br)(C(=O)C1=CC=CC=C1)C(=O)C1=CC=CC=C1 |
| Synonym | Dibenzoyldibromomethane |
| IUPAC Name | 2,2-dibromo-1,3-diphenylpropane-1,3-dione |
| InChI Key | GSWSUDFFJVJMLG-UHFFFAOYSA-N |
| Molecular Formula | C15H10Br2O2 |
4-Fluoro-4'-methylchalcone, TCI America™
CAS: 13565-38-3 Molecular Formula: C16H13FO Molecular Weight (g/mol): 240.277 MDL Number: MFCD00017981 InChI Key: LUUPODNGYDYQLY-IZZDOVSWSA-N Synonym: 4-fluoro-4'-methylchalcone,2e-3-4-fluorophenyl-1-4-methylphenyl prop-2-en-1-one,e-3-4-fluorophenyl-1-p-tolyl prop-2-en-1-one,e-3-4-fluorophenyl-1-4-methylphenyl prop-2-en-1-one,e-4-fluoro-4'-methylchalcone,2z-3-4-fluorophenyl-1-4-methylphenyl-2-propen-1-one,e-3-4-fluorophenyl-1-4-methylphenyl-2-propen-1-one PubChem CID: 5702626 IUPAC Name: (E)-3-(4-fluorophenyl)-1-(4-methylphenyl)prop-2-en-1-one SMILES: CC1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)F
| PubChem CID | 5702626 |
|---|---|
| CAS | 13565-38-3 |
| Molecular Weight (g/mol) | 240.277 |
| MDL Number | MFCD00017981 |
| SMILES | CC1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)F |
| Synonym | 4-fluoro-4'-methylchalcone,2e-3-4-fluorophenyl-1-4-methylphenyl prop-2-en-1-one,e-3-4-fluorophenyl-1-p-tolyl prop-2-en-1-one,e-3-4-fluorophenyl-1-4-methylphenyl prop-2-en-1-one,e-4-fluoro-4'-methylchalcone,2z-3-4-fluorophenyl-1-4-methylphenyl-2-propen-1-one,e-3-4-fluorophenyl-1-4-methylphenyl-2-propen-1-one |
| IUPAC Name | (E)-3-(4-fluorophenyl)-1-(4-methylphenyl)prop-2-en-1-one |
| InChI Key | LUUPODNGYDYQLY-IZZDOVSWSA-N |
| Molecular Formula | C16H13FO |
Isoliquiritigenin 97.0+%, TCI America™
CAS: 961-29-5 Molecular Formula: C15H12O4 Molecular Weight (g/mol): 256.257 MDL Number: MFCD00075907 InChI Key: DXDRHHKMWQZJHT-FPYGCLRLSA-N Synonym: isoliquiritigenin,2',4,4'-trihydroxychalcone,4,2',4'-trihydroxychalcone,6'-deoxychalcone,e-1-2,4-dihydroxyphenyl-3-4-hydroxyphenyl prop-2-en-1-one,2',4',4-trihydroxychalcone,isoliquirtigenin,unii-b9cti9gb8f,ccris 7676,chalcone, 2',4,4'-trihydroxy PubChem CID: 638278 ChEBI: CHEBI:310312 IUPAC Name: (E)-1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one SMILES: C1=CC(=CC=C1C=CC(=O)C2=C(C=C(C=C2)O)O)O
| PubChem CID | 638278 |
|---|---|
| CAS | 961-29-5 |
| Molecular Weight (g/mol) | 256.257 |
| ChEBI | CHEBI:310312 |
| MDL Number | MFCD00075907 |
| SMILES | C1=CC(=CC=C1C=CC(=O)C2=C(C=C(C=C2)O)O)O |
| Synonym | isoliquiritigenin,2',4,4'-trihydroxychalcone,4,2',4'-trihydroxychalcone,6'-deoxychalcone,e-1-2,4-dihydroxyphenyl-3-4-hydroxyphenyl prop-2-en-1-one,2',4',4-trihydroxychalcone,isoliquirtigenin,unii-b9cti9gb8f,ccris 7676,chalcone, 2',4,4'-trihydroxy |
| IUPAC Name | (E)-1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one |
| InChI Key | DXDRHHKMWQZJHT-FPYGCLRLSA-N |
| Molecular Formula | C15H12O4 |
3-Phenylpropiophenone, 98%
CAS: 1083-30-3 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.276 MDL Number: MFCD00039563 InChI Key: QGGZBXOADPVUPN-UHFFFAOYSA-N Synonym: dihydrochalcone,3-phenylpropiophenone,benzylacetophenone,hydrochalcone,1,3-diphenyl-1-propanone,beta-phenylpropiophenone,hydrocinnamophenone,1,3-diphenyl-1-oxopropane,phenethyl phenyl ketone,phenyl phenethyl ketone PubChem CID: 64802 ChEBI: CHEBI:71231 IUPAC Name: 1,3-diphenylpropan-1-one SMILES: C1=CC=C(C=C1)CCC(=O)C2=CC=CC=C2
| PubChem CID | 64802 |
|---|---|
| CAS | 1083-30-3 |
| Molecular Weight (g/mol) | 210.276 |
| ChEBI | CHEBI:71231 |
| MDL Number | MFCD00039563 |
| SMILES | C1=CC=C(C=C1)CCC(=O)C2=CC=CC=C2 |
| Synonym | dihydrochalcone,3-phenylpropiophenone,benzylacetophenone,hydrochalcone,1,3-diphenyl-1-propanone,beta-phenylpropiophenone,hydrocinnamophenone,1,3-diphenyl-1-oxopropane,phenethyl phenyl ketone,phenyl phenethyl ketone |
| IUPAC Name | 1,3-diphenylpropan-1-one |
| InChI Key | QGGZBXOADPVUPN-UHFFFAOYSA-N |
| Molecular Formula | C15H14O |
1,3-Diphenylpropane, 98%
CAS: 1081-75-0 Molecular Formula: C15H16 Molecular Weight (g/mol): 196.29 MDL Number: MFCD00043574 InChI Key: VEAFKIYNHVBNIP-UHFFFAOYSA-N Synonym: 1,3-diphenylpropane,3-phenylpropyl benzene,dibenzylmethane,propane, 1,3-diphenyl,unii-x3diq9w9po,3-phenyl-propyl-benzene,x3diq9w9po,benzene, 1,1'-1,3-propanediyl bis,propane, 1,3-diphenyl-8ci,benzene, 1,1'-1,3-propanediyl bis-9ci PubChem CID: 14125 ChEBI: CHEBI:34060 IUPAC Name: 3-phenylpropylbenzene SMILES: C(CC1=CC=CC=C1)CC1=CC=CC=C1
| PubChem CID | 14125 |
|---|---|
| CAS | 1081-75-0 |
| Molecular Weight (g/mol) | 196.29 |
| ChEBI | CHEBI:34060 |
| MDL Number | MFCD00043574 |
| SMILES | C(CC1=CC=CC=C1)CC1=CC=CC=C1 |
| Synonym | 1,3-diphenylpropane,3-phenylpropyl benzene,dibenzylmethane,propane, 1,3-diphenyl,unii-x3diq9w9po,3-phenyl-propyl-benzene,x3diq9w9po,benzene, 1,1'-1,3-propanediyl bis,propane, 1,3-diphenyl-8ci,benzene, 1,1'-1,3-propanediyl bis-9ci |
| IUPAC Name | 3-phenylpropylbenzene |
| InChI Key | VEAFKIYNHVBNIP-UHFFFAOYSA-N |
| Molecular Formula | C15H16 |
4,4'-Dimethoxychalcone, 99%
CAS: 2373-89-9 Molecular Formula: C17H16O3 Molecular Weight (g/mol): 268.31 MDL Number: MFCD00025815 InChI Key: HDXVSZWKIHQDES-LFYBBSHMSA-N Synonym: 4,4'-dimethoxychalcone,e-1,3-bis 4-methoxyphenyl prop-2-en-1-one,2e-1,3-bis 4-methoxyphenyl prop-2-en-1-one,1,3-bis 4-methoxyphenyl prop-2-en-1-one,4,4/'-dimethoxychalcone,2-propen-1-one, 1,3-bis 4-methoxyphenyl,e-4,4'-dimethoxychalcone,1,3-bis 4-methoxyphenyl-2-propen-1-one,e-1,3-bis 4-methoxyphenyl-2-propen-1-one,2e-1,3-bis 4-methoxyphenyl-2-propen-1-one PubChem CID: 5377817 IUPAC Name: (E)-1,3-bis(4-methoxyphenyl)prop-2-en-1-one SMILES: COC1=CC=C(\C=C\C(=O)C2=CC=C(OC)C=C2)C=C1
| PubChem CID | 5377817 |
|---|---|
| CAS | 2373-89-9 |
| Molecular Weight (g/mol) | 268.31 |
| MDL Number | MFCD00025815 |
| SMILES | COC1=CC=C(\C=C\C(=O)C2=CC=C(OC)C=C2)C=C1 |
| Synonym | 4,4'-dimethoxychalcone,e-1,3-bis 4-methoxyphenyl prop-2-en-1-one,2e-1,3-bis 4-methoxyphenyl prop-2-en-1-one,1,3-bis 4-methoxyphenyl prop-2-en-1-one,4,4/'-dimethoxychalcone,2-propen-1-one, 1,3-bis 4-methoxyphenyl,e-4,4'-dimethoxychalcone,1,3-bis 4-methoxyphenyl-2-propen-1-one,e-1,3-bis 4-methoxyphenyl-2-propen-1-one,2e-1,3-bis 4-methoxyphenyl-2-propen-1-one |
| IUPAC Name | (E)-1,3-bis(4-methoxyphenyl)prop-2-en-1-one |
| InChI Key | HDXVSZWKIHQDES-LFYBBSHMSA-N |
| Molecular Formula | C17H16O3 |
4,4'-Dichlorochalcone, 98+%
CAS: 19672-59-4 Molecular Formula: C15H10Cl2O Molecular Weight (g/mol): 277.14 MDL Number: MFCD00018704 InChI Key: YMEMCRBNZSLQCQ-XCVCLJGOSA-N Synonym: 4,4'-dichlorochalcone,e-1,3-bis-4-chloro-phenyl-propenone,e-1,3-bis 4-chlorophenyl prop-2-en-1-one,2e-1,3-bis 4-chlorophenyl prop-2-en-1-one,2e-1,3-bis 4-chlorophenyl-2-propen-1-one,4',4-dichlorochalcone,e-4,4'-dichlorochalcone,trans-1,3-di-4-chlorophenyl-prop-2-en-1-one PubChem CID: 5377011 IUPAC Name: (E)-1,3-bis(4-chlorophenyl)prop-2-en-1-one SMILES: ClC1=CC=C(\C=C\C(=O)C2=CC=C(Cl)C=C2)C=C1
| PubChem CID | 5377011 |
|---|---|
| CAS | 19672-59-4 |
| Molecular Weight (g/mol) | 277.14 |
| MDL Number | MFCD00018704 |
| SMILES | ClC1=CC=C(\C=C\C(=O)C2=CC=C(Cl)C=C2)C=C1 |
| Synonym | 4,4'-dichlorochalcone,e-1,3-bis-4-chloro-phenyl-propenone,e-1,3-bis 4-chlorophenyl prop-2-en-1-one,2e-1,3-bis 4-chlorophenyl prop-2-en-1-one,2e-1,3-bis 4-chlorophenyl-2-propen-1-one,4',4-dichlorochalcone,e-4,4'-dichlorochalcone,trans-1,3-di-4-chlorophenyl-prop-2-en-1-one |
| IUPAC Name | (E)-1,3-bis(4-chlorophenyl)prop-2-en-1-one |
| InChI Key | YMEMCRBNZSLQCQ-XCVCLJGOSA-N |
| Molecular Formula | C15H10Cl2O |
Phloretin, 98%
CAS: 60-82-2 Molecular Formula: C15H14O5 Molecular Weight (g/mol): 274.272 MDL Number: MFCD00002288 InChI Key: VGEREEWJJVICBM-UHFFFAOYSA-N Synonym: phloretin,dihydronaringenin,3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl propan-1-one,phloretol,3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl-1-propanone,unii-s5j5oe47mk,1-propanone, 3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl,ccris 7459,beta-p-hydroxyphenyl phloropropiophenone,2',4',6'-trihydroxy-3-p-hydroxyphenyl propiophenone PubChem CID: 4788 ChEBI: CHEBI:17276 IUPAC Name: 3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one SMILES: C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2O)O)O)O
| PubChem CID | 4788 |
|---|---|
| CAS | 60-82-2 |
| Molecular Weight (g/mol) | 274.272 |
| ChEBI | CHEBI:17276 |
| MDL Number | MFCD00002288 |
| SMILES | C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2O)O)O)O |
| Synonym | phloretin,dihydronaringenin,3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl propan-1-one,phloretol,3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl-1-propanone,unii-s5j5oe47mk,1-propanone, 3-4-hydroxyphenyl-1-2,4,6-trihydroxyphenyl,ccris 7459,beta-p-hydroxyphenyl phloropropiophenone,2',4',6'-trihydroxy-3-p-hydroxyphenyl propiophenone |
| IUPAC Name | 3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one |
| InChI Key | VGEREEWJJVICBM-UHFFFAOYSA-N |
| Molecular Formula | C15H14O5 |
Dibenzyl ketoxime, 98+%
CAS: 1788-31-4 Molecular Formula: C15H15NO Molecular Weight (g/mol): 225.291 MDL Number: MFCD00015453 InChI Key: SXEBLVKLMOIGER-UHFFFAOYSA-N Synonym: dibenzyl ketoxime,1,3-diphenylacetone oxime,1,3-diphenylpropan-2-one oxime,2-propanone, 1,3-diphenyl-, oxime,n-1,3-diphenylpropan-2-ylidene hydroxylamine,2-hydroxyimino-1,3-diphenylpropane,dibenzylketoxim,maybridge4_000477,dibenzyl ketoxime, 98+%,1,3-diphenylacetone oxime # PubChem CID: 74518 IUPAC Name: N-(1,3-diphenylpropan-2-ylidene)hydroxylamine SMILES: C1=CC=C(C=C1)CC(=NO)CC2=CC=CC=C2
| PubChem CID | 74518 |
|---|---|
| CAS | 1788-31-4 |
| Molecular Weight (g/mol) | 225.291 |
| MDL Number | MFCD00015453 |
| SMILES | C1=CC=C(C=C1)CC(=NO)CC2=CC=CC=C2 |
| Synonym | dibenzyl ketoxime,1,3-diphenylacetone oxime,1,3-diphenylpropan-2-one oxime,2-propanone, 1,3-diphenyl-, oxime,n-1,3-diphenylpropan-2-ylidene hydroxylamine,2-hydroxyimino-1,3-diphenylpropane,dibenzylketoxim,maybridge4_000477,dibenzyl ketoxime, 98+%,1,3-diphenylacetone oxime # |
| IUPAC Name | N-(1,3-diphenylpropan-2-ylidene)hydroxylamine |
| InChI Key | SXEBLVKLMOIGER-UHFFFAOYSA-N |
| Molecular Formula | C15H15NO |
4-Methoxychalcone, 97%
CAS: 959-33-1 Molecular Formula: C16H14O2 Molecular Weight (g/mol): 238.286 MDL Number: MFCD00017179 InChI Key: XUFXKBJMCRJATM-FMIVXFBMSA-N Synonym: 4-methoxychalcone,e-3-4-methoxyphenyl-1-phenylprop-2-en-1-one,2e-3-4-methoxyphenyl-1-phenylprop-2-en-1-one,chalcone, 4-methoxy,3-4-methoxyphenyl-1-phenyl-2-propen-1-one,2-propen-1-one, 3-4-methoxyphenyl-1-phenyl,2-propen-1-one, 3-4-methoxyphenyl-1-phenyl-, 2e,phenyl p-methoxystyryl ketone,4'-methoxybenzylideneacetophenone,3-4-methoxyphenyl-1-phenylprop-2-en-1-one PubChem CID: 641819 IUPAC Name: (E)-3-(4-methoxyphenyl)-1-phenylprop-2-en-1-one SMILES: COC1=CC=C(C=C1)C=CC(=O)C2=CC=CC=C2
| PubChem CID | 641819 |
|---|---|
| CAS | 959-33-1 |
| Molecular Weight (g/mol) | 238.286 |
| MDL Number | MFCD00017179 |
| SMILES | COC1=CC=C(C=C1)C=CC(=O)C2=CC=CC=C2 |
| Synonym | 4-methoxychalcone,e-3-4-methoxyphenyl-1-phenylprop-2-en-1-one,2e-3-4-methoxyphenyl-1-phenylprop-2-en-1-one,chalcone, 4-methoxy,3-4-methoxyphenyl-1-phenyl-2-propen-1-one,2-propen-1-one, 3-4-methoxyphenyl-1-phenyl,2-propen-1-one, 3-4-methoxyphenyl-1-phenyl-, 2e,phenyl p-methoxystyryl ketone,4'-methoxybenzylideneacetophenone,3-4-methoxyphenyl-1-phenylprop-2-en-1-one |
| IUPAC Name | (E)-3-(4-methoxyphenyl)-1-phenylprop-2-en-1-one |
| InChI Key | XUFXKBJMCRJATM-FMIVXFBMSA-N |
| Molecular Formula | C16H14O2 |
1,3-Diphenylacetone, 98+%
CAS: 102-04-5 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.28 MDL Number: MFCD00004795 InChI Key: YFKBXYGUSOXJGS-UHFFFAOYSA-N Synonym: 1,3-diphenylacetone,dibenzyl ketone,1,3-diphenyl-2-propanone,benzyl ketone,2-propanone, 1,3-diphenyl,1,3-diphenylpropanone,alpha,alpha'-diphenylacetone,1,3-diphenyl-propan-2-one,unii-9y07g5udkq,fema no. 2397 PubChem CID: 7593 IUPAC Name: 1,3-diphenylpropan-2-one SMILES: O=C(CC1=CC=CC=C1)CC1=CC=CC=C1
| PubChem CID | 7593 |
|---|---|
| CAS | 102-04-5 |
| Molecular Weight (g/mol) | 210.28 |
| MDL Number | MFCD00004795 |
| SMILES | O=C(CC1=CC=CC=C1)CC1=CC=CC=C1 |
| Synonym | 1,3-diphenylacetone,dibenzyl ketone,1,3-diphenyl-2-propanone,benzyl ketone,2-propanone, 1,3-diphenyl,1,3-diphenylpropanone,alpha,alpha'-diphenylacetone,1,3-diphenyl-propan-2-one,unii-9y07g5udkq,fema no. 2397 |
| IUPAC Name | 1,3-diphenylpropan-2-one |
| InChI Key | YFKBXYGUSOXJGS-UHFFFAOYSA-N |
| Molecular Formula | C15H14O |
Neohesperidin dihydrochalcone hydrate, 98+%
CAS: 20702-77-6 Molecular Formula: C28H36O15 Molecular Weight (g/mol): 612.58 MDL Number: MFCD00017711 InChI Key: ITVGXXMINPYUHD-UHFFFAOYSA-N Synonym: neohesperidin dihydrochalcone,nhdc,neohesperidin dc,neohesperidin dhc,unii-3x476d83qv,ccris 4848,neosperidin dihydrochalcone,neohesperidine dihydrochalcone,1-4-2-o-6-deoxy-alpha-l-mannopyranosyl-beta-d-glucopyranosyl oxy-2,6-dihydroxyphenyl-3-3-hydroxy-4-methoxyphenyl propan-1-one,1-4-2-o-6-deoxy-alpha-l-mannopyranosyl-beta-d-glucopyranosyl oxy-2,6-dihydroxyphenyl-3-3-hydroxy-4-methoxyphenyl PubChem CID: 30231 ChEBI: CHEBI:83535 IUPAC Name: 1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)propan-1-one SMILES: COC1=C(O)C=C(CCC(=O)C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)C=C2O)C=C1
| PubChem CID | 30231 |
|---|---|
| CAS | 20702-77-6 |
| Molecular Weight (g/mol) | 612.58 |
| ChEBI | CHEBI:83535 |
| MDL Number | MFCD00017711 |
| SMILES | COC1=C(O)C=C(CCC(=O)C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)C=C2O)C=C1 |
| Synonym | neohesperidin dihydrochalcone,nhdc,neohesperidin dc,neohesperidin dhc,unii-3x476d83qv,ccris 4848,neosperidin dihydrochalcone,neohesperidine dihydrochalcone,1-4-2-o-6-deoxy-alpha-l-mannopyranosyl-beta-d-glucopyranosyl oxy-2,6-dihydroxyphenyl-3-3-hydroxy-4-methoxyphenyl propan-1-one,1-4-2-o-6-deoxy-alpha-l-mannopyranosyl-beta-d-glucopyranosyl oxy-2,6-dihydroxyphenyl-3-3-hydroxy-4-methoxyphenyl |
| IUPAC Name | 1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)propan-1-one |
| InChI Key | ITVGXXMINPYUHD-UHFFFAOYSA-N |
| Molecular Formula | C28H36O15 |