Organic compounds
Organic compounds are a class of chemical compounds that contain one or more atoms of carbon covalently bonded to each other and atoms of other elements such as hydrogen, oxygen, nitrogen, sulfur, etc.
Compounds or allotropes of carbon that contain only carbon atoms are classified as inorganic compounds and exhibit novel properties.
This class of chemicals has a wide range of applications and includes graphite, diamond, and the more recently discovered graphene, fullerenes, and other carbon nanotubes. In fact, the majority of elements in the periodic table of elements are inorganic compounds.
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N-Methylpyrrolidone, ACS Reagent, for organic synthesis, prep-LC, and general laboratory use, >99.0%, Honeywell
CAS: 872-50-4 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.133 InChI Key: SECXISVLQFMRJM-UHFFFAOYSA-N Synonym: 1-methyl-2-pyrrolidinone,n-methyl-2-pyrrolidone,n-methylpyrrolidone,1-methyl-2-pyrrolidone,methylpyrrolidone,m-pyrol,n-methyl-2-pyrrolidinone,n-methylpyrrolidinone,1-methylpyrrolidinone,2-pyrrolidinone, 1-methyl PubChem CID: 13387 ChEBI: CHEBI:7307 IUPAC Name: 1-methylpyrrolidin-2-one SMILES: CN1CCCC1=O
| PubChem CID | 13387 |
|---|---|
| CAS | 872-50-4 |
| Molecular Weight (g/mol) | 99.133 |
| ChEBI | CHEBI:7307 |
| SMILES | CN1CCCC1=O |
| Synonym | 1-methyl-2-pyrrolidinone,n-methyl-2-pyrrolidone,n-methylpyrrolidone,1-methyl-2-pyrrolidone,methylpyrrolidone,m-pyrol,n-methyl-2-pyrrolidinone,n-methylpyrrolidinone,1-methylpyrrolidinone,2-pyrrolidinone, 1-methyl |
| IUPAC Name | 1-methylpyrrolidin-2-one |
| InChI Key | SECXISVLQFMRJM-UHFFFAOYSA-N |
| Molecular Formula | C5H9NO |
1,1,1,3,3,3-Hexafluoro-2-propanol, 99.8%, for peptide synthesis
CAS: 920-66-1 Molecular Formula: C3H2F6O Molecular Weight (g/mol): 168.04 MDL Number: MFCD00011651 InChI Key: BYEAHWXPCBROCE-UHFFFAOYSA-N Synonym: 1,1,1,3,3,3-hexafluoro-2-propanol,hexafluoroisopropanol,hfip,hexafluoro-2-propanol,hexafluoroisopropyl alcohol,bis trifluoromethyl methanol,1,1,1,3,3,3-hexafluoroisopropanol,2h-hexafluoroisopropanol,2-propanol, 1,1,1,3,3,3-hexafluoro,1,1,1,3,3,3-hexafluoroisopropyl alcohol PubChem CID: 13529 ChEBI: CHEBI:63104 IUPAC Name: 1,1,1,3,3,3-hexafluoropropan-2-ol SMILES: C(C(F)(F)F)(C(F)(F)F)O
| PubChem CID | 13529 |
|---|---|
| CAS | 920-66-1 |
| Molecular Weight (g/mol) | 168.04 |
| ChEBI | CHEBI:63104 |
| MDL Number | MFCD00011651 |
| SMILES | C(C(F)(F)F)(C(F)(F)F)O |
| Synonym | 1,1,1,3,3,3-hexafluoro-2-propanol,hexafluoroisopropanol,hfip,hexafluoro-2-propanol,hexafluoroisopropyl alcohol,bis trifluoromethyl methanol,1,1,1,3,3,3-hexafluoroisopropanol,2h-hexafluoroisopropanol,2-propanol, 1,1,1,3,3,3-hexafluoro,1,1,1,3,3,3-hexafluoroisopropyl alcohol |
| IUPAC Name | 1,1,1,3,3,3-hexafluoropropan-2-ol |
| InChI Key | BYEAHWXPCBROCE-UHFFFAOYSA-N |
| Molecular Formula | C3H2F6O |
Bis(ethylenedithio)tetrathiafulvalene [Organic Electronic Material], TCI America™
CAS: 66946-48-3 Molecular Formula: C10H8S8 Molecular Weight (g/mol): 384.65 MDL Number: MFCD00059710 InChI Key: LZJCVNLYDXCIBG-UHFFFAOYSA-N Synonym: bis ethylenedithio tetrathiafulvalene,bedt-ttf,2-5h,6h-1,3 dithiolo 4,5-b 1,4 dithiin-2-ylidene-5h,6h-1,3 dithiolo 4,5-b 1,4 dithiine,bis ethylenedithio tetrathiofulvalene,bis ethylenedithiolo tetrathiafulvalene,bis-ethylenedithio tetrathiafulvalene,bis ethylenedithiolo tetrathiafulvalene 250mg,bi 5,6-dihydro-1,3-dithiolo 4,5-b 1,4-dithiine-2-ylidene,2-5,6-dihydro-1,3 dithiolo 4,5-b 1,4 dithiin-2-ylidene-5,6-dihydro-1,3 dithiolo 4,5-b 1,4 dithiine PubChem CID: 633432 IUPAC Name: 2-{2H,5H,6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-ylidene}-2H,5H,6H-[1,3]dithiolo[4,5-b][1,4]dithiine SMILES: C1CSC2=C(SC(S2)=C2SC3=C(S2)SCCS3)S1
| PubChem CID | 633432 |
|---|---|
| CAS | 66946-48-3 |
| Molecular Weight (g/mol) | 384.65 |
| MDL Number | MFCD00059710 |
| SMILES | C1CSC2=C(SC(S2)=C2SC3=C(S2)SCCS3)S1 |
| Synonym | bis ethylenedithio tetrathiafulvalene,bedt-ttf,2-5h,6h-1,3 dithiolo 4,5-b 1,4 dithiin-2-ylidene-5h,6h-1,3 dithiolo 4,5-b 1,4 dithiine,bis ethylenedithio tetrathiofulvalene,bis ethylenedithiolo tetrathiafulvalene,bis-ethylenedithio tetrathiafulvalene,bis ethylenedithiolo tetrathiafulvalene 250mg,bi 5,6-dihydro-1,3-dithiolo 4,5-b 1,4-dithiine-2-ylidene,2-5,6-dihydro-1,3 dithiolo 4,5-b 1,4 dithiin-2-ylidene-5,6-dihydro-1,3 dithiolo 4,5-b 1,4 dithiine |
| IUPAC Name | 2-{2H,5H,6H-[1,3]dithiolo[4,5-b][1,4]dithiin-2-ylidene}-2H,5H,6H-[1,3]dithiolo[4,5-b][1,4]dithiine |
| InChI Key | LZJCVNLYDXCIBG-UHFFFAOYSA-N |
| Molecular Formula | C10H8S8 |
Bis(methylenedithio)tetrathiafulvalene [Organic Electronic Material], TCI America™
CAS: 68550-20-9 Molecular Formula: C8H4S8 Molecular Weight (g/mol): 356.6 MDL Number: MFCD00059697 InChI Key: YAHVGMRXXZDSOK-UHFFFAOYSA-N Synonym: BMDT-TTF PubChem CID: 13740883 IUPAC Name: 5-([1,3]dithiolo[4,5-d][1,3]dithiol-5-ylidene)-[1,3]dithiolo[4,5-d][1,3]dithiole SMILES: C1SC2=C(S1)SC(=C3SC4=C(S3)SCS4)S2
| PubChem CID | 13740883 |
|---|---|
| CAS | 68550-20-9 |
| Molecular Weight (g/mol) | 356.6 |
| MDL Number | MFCD00059697 |
| SMILES | C1SC2=C(S1)SC(=C3SC4=C(S3)SCS4)S2 |
| Synonym | BMDT-TTF |
| IUPAC Name | 5-([1,3]dithiolo[4,5-d][1,3]dithiol-5-ylidene)-[1,3]dithiolo[4,5-d][1,3]dithiole |
| InChI Key | YAHVGMRXXZDSOK-UHFFFAOYSA-N |
| Molecular Formula | C8H4S8 |
Tetrakis(ethylthio)tetrathiafulvalene [Organic Electronic Material], TCI America™
CAS: 104515-79-9 Molecular Formula: C14H20S8 Molecular Weight (g/mol): 444.79 MDL Number: MFCD00137866 InChI Key: LLDJYFLUQDMPQI-UHFFFAOYSA-N Synonym: TET-TTF PubChem CID: 3524833 IUPAC Name: 2-[4,5-bis(ethylsulfanyl)-2H-1,3-dithiol-2-ylidene]-4,5-bis(ethylsulfanyl)-2H-1,3-dithiole SMILES: CCSC1=C(SCC)SC(S1)=C1SC(SCC)=C(SCC)S1
| PubChem CID | 3524833 |
|---|---|
| CAS | 104515-79-9 |
| Molecular Weight (g/mol) | 444.79 |
| MDL Number | MFCD00137866 |
| SMILES | CCSC1=C(SCC)SC(S1)=C1SC(SCC)=C(SCC)S1 |
| Synonym | TET-TTF |
| IUPAC Name | 2-[4,5-bis(ethylsulfanyl)-2H-1,3-dithiol-2-ylidene]-4,5-bis(ethylsulfanyl)-2H-1,3-dithiole |
| InChI Key | LLDJYFLUQDMPQI-UHFFFAOYSA-N |
| Molecular Formula | C14H20S8 |
TraceCERT™ EPA VOC Mix 8, Certified Reference Material, MilliporeSigma™ Supelco™
This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.
Polyethylene Glycol 8000 (PEG), Fisher BioReagents™
CAS: 25322-68-3 Molecular Formula: (C2H4O)n Molecular Weight (g/mol): 62.07 MDL Number: MFCD01779601 InChI Key: LYCAIKOWRPUZTN-UHFFFAOYSA-N Synonym: PEG 8000,Polyethylene Oxide,Carbowax™ IUPAC Name: ethane-1,2-diol SMILES: [H]OCCO
| CAS | 25322-68-3 |
|---|---|
| Molecular Weight (g/mol) | 62.07 |
| MDL Number | MFCD01779601 |
| SMILES | [H]OCCO |
| Synonym | PEG 8000,Polyethylene Oxide,Carbowax™ |
| IUPAC Name | ethane-1,2-diol |
| InChI Key | LYCAIKOWRPUZTN-UHFFFAOYSA-N |
| Molecular Formula | (C2H4O)n |
Poly(styrene-divinylbenzene), 1% cross-linked, 200-400 mesh
CAS: 9003-70-7 Molecular Formula: C24H27NO5 Molecular Weight (g/mol): 409.48 MDL Number: 9003-70-7 InChI Key: BCIPGSZQUDLGSY-UHFFFAOYNA-N Synonym: styrene/divinylbenzen,divinylbenzene-styrene,styrene divinylbenzene,styrene-divinylbenzene,styrene/divinylbenzene,styrene-divinyl benzene,benzene, diethenyl-, polymer with ethenylbenzene, brominated,st dvb,divinylbenzene; styrene,1,2-diethenylbenzene; styrene PubChem CID: 174664 IUPAC Name: 1,2-bis(ethenyl)benzene;styrene SMILES: CC(C)(C)OC(=O)CCC(NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C=O
| PubChem CID | 174664 |
|---|---|
| CAS | 9003-70-7 |
| Molecular Weight (g/mol) | 409.48 |
| MDL Number | 9003-70-7 |
| SMILES | CC(C)(C)OC(=O)CCC(NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C=O |
| Synonym | styrene/divinylbenzen,divinylbenzene-styrene,styrene divinylbenzene,styrene-divinylbenzene,styrene/divinylbenzene,styrene-divinyl benzene,benzene, diethenyl-, polymer with ethenylbenzene, brominated,st dvb,divinylbenzene; styrene,1,2-diethenylbenzene; styrene |
| IUPAC Name | 1,2-bis(ethenyl)benzene;styrene |
| InChI Key | BCIPGSZQUDLGSY-UHFFFAOYNA-N |
| Molecular Formula | C24H27NO5 |
Thermo Scientific Chemicals Cytidine-5'-diphosphocholine sodium salt
CAS: 33818-15-4 Molecular Formula: C14H25N4NaO11P2 Molecular Weight (g/mol): 510.31 MDL Number: MFCD00150508 InChI Key: YWAFNFGRBBBSPD-OCMLZEEQSA-M Synonym: citicolinesodium,cytidine 5'-diphosphocholine sodium,cdp-choline sodium,citicoline, sodium,cdp-choline, sodium,cytidine 5'-diphosphocholine sodium salt,cytidine 5'-diphosphocholine sodium salt dihydrate,cytidine-5'-diphosphocholine monosodium salt,sodium 2s,3r,4s,5s-5-4-amino-2-oxo-1-pyrimidinyl-3,4-dihydroxy-2-oxolanyl methoxy-oxidophosphoryl 2-trimethylammonio ethyl phosphate,sodium 2s,3r,4s,5s-5-4-azanyl-2-oxidanylidene-pyrimidin-1-yl-3,4-bis oxidanyl oxolan-2-yl methoxy-oxidanidyl-phosphoryl 2-trimethylazaniumyl ethyl phosphate PubChem CID: 46738085 IUPAC Name: sodium;[[(2S,3R,4S,5S)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] 2-(trimethylazaniumyl)ethyl phosphate SMILES: [Na+].C[N+](C)(C)CCOP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=CC(N)=NC1=O
| PubChem CID | 46738085 |
|---|---|
| CAS | 33818-15-4 |
| Molecular Weight (g/mol) | 510.31 |
| MDL Number | MFCD00150508 |
| SMILES | [Na+].C[N+](C)(C)CCOP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=CC(N)=NC1=O |
| Synonym | citicolinesodium,cytidine 5'-diphosphocholine sodium,cdp-choline sodium,citicoline, sodium,cdp-choline, sodium,cytidine 5'-diphosphocholine sodium salt,cytidine 5'-diphosphocholine sodium salt dihydrate,cytidine-5'-diphosphocholine monosodium salt,sodium 2s,3r,4s,5s-5-4-amino-2-oxo-1-pyrimidinyl-3,4-dihydroxy-2-oxolanyl methoxy-oxidophosphoryl 2-trimethylammonio ethyl phosphate,sodium 2s,3r,4s,5s-5-4-azanyl-2-oxidanylidene-pyrimidin-1-yl-3,4-bis oxidanyl oxolan-2-yl methoxy-oxidanidyl-phosphoryl 2-trimethylazaniumyl ethyl phosphate |
| IUPAC Name | sodium;[[(2S,3R,4S,5S)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-oxidophosphoryl] 2-(trimethylazaniumyl)ethyl phosphate |
| InChI Key | YWAFNFGRBBBSPD-OCMLZEEQSA-M |
| Molecular Formula | C14H25N4NaO11P2 |
Triflumuron, 98+%, Thermo Scientific Chemicals
CAS: 64628-44-0 Molecular Formula: C15H10ClF3N2O3 Molecular Weight (g/mol): 358.701 MDL Number: MFCD00072496 InChI Key: XAIPTRIXGHTTNT-UHFFFAOYSA-N Synonym: triflumuron,alsystin,trifluron,mascot,alsystine,triflumuron iso,caswell no. 217c,bay-sir 8514,unii-3ft64dyg8k,bay-vi 7533 PubChem CID: 47445 ChEBI: CHEBI:39388 IUPAC Name: 2-chloro-N-[[4-(trifluoromethoxy)phenyl]carbamoyl]benzamide SMILES: C1=CC=C(C(=C1)C(=O)NC(=O)NC2=CC=C(C=C2)OC(F)(F)F)Cl
| PubChem CID | 47445 |
|---|---|
| CAS | 64628-44-0 |
| Molecular Weight (g/mol) | 358.701 |
| ChEBI | CHEBI:39388 |
| MDL Number | MFCD00072496 |
| SMILES | C1=CC=C(C(=C1)C(=O)NC(=O)NC2=CC=C(C=C2)OC(F)(F)F)Cl |
| Synonym | triflumuron,alsystin,trifluron,mascot,alsystine,triflumuron iso,caswell no. 217c,bay-sir 8514,unii-3ft64dyg8k,bay-vi 7533 |
| IUPAC Name | 2-chloro-N-[[4-(trifluoromethoxy)phenyl]carbamoyl]benzamide |
| InChI Key | XAIPTRIXGHTTNT-UHFFFAOYSA-N |
| Molecular Formula | C15H10ClF3N2O3 |
Barium isopropoxide, 20% w/v in isopropanol
CAS: 24363-37-9 Molecular Formula: C6H14BaO2 Molecular Weight (g/mol): 255.503 MDL Number: MFCD00050486 InChI Key: CPUJSIVIXCTVEI-UHFFFAOYSA-N Synonym: barium isopropoxide,barium 2+ ; propan-2-olate,barium diisopropoxide,acmc-20alr0,barium ii isopropoxide,barium 2+ bis propan-2-olate,barium 2+ ion bis propan-2-olate PubChem CID: 6101105 IUPAC Name: barium(2+);propan-2-olate SMILES: CC(C)[O-].CC(C)[O-].[Ba+2]
| PubChem CID | 6101105 |
|---|---|
| CAS | 24363-37-9 |
| Molecular Weight (g/mol) | 255.503 |
| MDL Number | MFCD00050486 |
| SMILES | CC(C)[O-].CC(C)[O-].[Ba+2] |
| Synonym | barium isopropoxide,barium 2+ ; propan-2-olate,barium diisopropoxide,acmc-20alr0,barium ii isopropoxide,barium 2+ bis propan-2-olate,barium 2+ ion bis propan-2-olate |
| IUPAC Name | barium(2+);propan-2-olate |
| InChI Key | CPUJSIVIXCTVEI-UHFFFAOYSA-N |
| Molecular Formula | C6H14BaO2 |
MilliporeSigma™ UDP-α-D-N-Acetylglucosamine, Disodium Salt, >95% Calbiochem™,
CAS: 91183-98-1 Molecular Formula: C17H27N3Na2O17P2 Molecular Weight (g/mol): 653.334 InChI Key: QPWKUQXSMYTKRZ-YZVFIFBQSA-N Synonym: uridine 5'-diphospho-n-acetyl-*glucosamine sodium PubChem CID: 131863333 IUPAC Name: [(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] [[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate;sodium SMILES: CC(=O)NC1C(C(C(OC1OP(=O)(O)OP(=O)(O)OCC2C(C(C(O2)N3C=CC(=O)NC3=O)O)O)CO)O)O.[Na].[Na]
| PubChem CID | 131863333 |
|---|---|
| CAS | 91183-98-1 |
| Molecular Weight (g/mol) | 653.334 |
| SMILES | CC(=O)NC1C(C(C(OC1OP(=O)(O)OP(=O)(O)OCC2C(C(C(O2)N3C=CC(=O)NC3=O)O)O)CO)O)O.[Na].[Na] |
| Synonym | uridine 5'-diphospho-n-acetyl-*glucosamine sodium |
| IUPAC Name | [(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] [[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate;sodium |
| InChI Key | QPWKUQXSMYTKRZ-YZVFIFBQSA-N |
| Molecular Formula | C17H27N3Na2O17P2 |
(1S,2S)-(+)-2-Amino-1-phenyl-1,3-propanediol, 97%
CAS: 28143-91-1 Molecular Formula: C9H13NO2 Molecular Weight (g/mol): 167.208 MDL Number: MFCD00004503 InChI Key: JUCGVCVPNPBJIG-IUCAKERBSA-N PubChem CID: 119881 IUPAC Name: (1S,2S)-2-amino-1-phenylpropane-1,3-diol SMILES: C1=CC=C(C=C1)C(C(CO)N)O
| PubChem CID | 119881 |
|---|---|
| CAS | 28143-91-1 |
| Molecular Weight (g/mol) | 167.208 |
| MDL Number | MFCD00004503 |
| SMILES | C1=CC=C(C=C1)C(C(CO)N)O |
| IUPAC Name | (1S,2S)-2-amino-1-phenylpropane-1,3-diol |
| InChI Key | JUCGVCVPNPBJIG-IUCAKERBSA-N |
| Molecular Formula | C9H13NO2 |
2,3-O-Isopropylidene-D-erythronolactone, 98%, Thermo Scientific Chemicals
CAS: 25581-41-3 Molecular Formula: C7H10O4 Molecular Weight (g/mol): 158.15 MDL Number: MFCD00134440 InChI Key: WHPSMBYLYRPVGU-UHFFFAOYNA-N Synonym: 2,3-o-isopropylidene-d-erythronolactone,--2,3-o-isopropylidene-d-erythronolactone,3ar,6ar-2,2-dimethyldihydrofuro 3,4-d 1,3 dioxol-4 3ah-one,3ar,6ar-2,2-dimethyl-6,6a-dihydro-3ah-furo 3,4-d 1,3 dioxol-4-one,3ar,6ar-2,2-dimethyl-dihydro-3ah-furo 3,4-d 1,3 dioxol-4-one,pubchem19725,2,3-o-isopropylidene-d-erythronolactol,d-2,3-o-isopropylidene-erythronic acid,a-lactone,2-o,3-o-isopropylidene-d-erythronic acid gamma-lactone PubChem CID: 386843 IUPAC Name: (3aR,6aR)-2,2-dimethyl-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxol-4-one SMILES: CC1(C)OC2COC(=O)C2O1
| PubChem CID | 386843 |
|---|---|
| CAS | 25581-41-3 |
| Molecular Weight (g/mol) | 158.15 |
| MDL Number | MFCD00134440 |
| SMILES | CC1(C)OC2COC(=O)C2O1 |
| Synonym | 2,3-o-isopropylidene-d-erythronolactone,--2,3-o-isopropylidene-d-erythronolactone,3ar,6ar-2,2-dimethyldihydrofuro 3,4-d 1,3 dioxol-4 3ah-one,3ar,6ar-2,2-dimethyl-6,6a-dihydro-3ah-furo 3,4-d 1,3 dioxol-4-one,3ar,6ar-2,2-dimethyl-dihydro-3ah-furo 3,4-d 1,3 dioxol-4-one,pubchem19725,2,3-o-isopropylidene-d-erythronolactol,d-2,3-o-isopropylidene-erythronic acid,a-lactone,2-o,3-o-isopropylidene-d-erythronic acid gamma-lactone |
| IUPAC Name | (3aR,6aR)-2,2-dimethyl-6,6a-dihydro-3aH-furo[3,4-d][1,3]dioxol-4-one |
| InChI Key | WHPSMBYLYRPVGU-UHFFFAOYNA-N |
| Molecular Formula | C7H10O4 |
Hygromycin B Solution, ≥80%, MP Biomedicals™
CAS: 31282-04-9 Molecular Formula: C20H37N3O13 Molecular Weight (g/mol): 527.524 MDL Number: MFCD06795479 InChI Key: GRRNUXAQVGOGFE-BBMONYMYSA-N Synonym: hygromycin b PubChem CID: 134129613 IUPAC Name: (3'S,3aS,4S,4'S,5'R,6R,6'R,7R,7aS)-4-[(1R,2S,3R,5S,6S)-3-amino-2,6-dihydroxy-5-(methylamino)cyclohexyl]oxy-6'-[(1S)-1-amino-2-hydroxyethyl]-6-(hydroxymethyl)spiro[4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-2,2'-oxane]-3',4',5',7-tetrol SMILES: CNC1CC(C(C(C1O)OC2C3C(C(C(O2)CO)O)OC4(O3)C(C(C(C(O4)C(CO)N)O)O)O)O)N
| PubChem CID | 134129613 |
|---|---|
| CAS | 31282-04-9 |
| Molecular Weight (g/mol) | 527.524 |
| MDL Number | MFCD06795479 |
| SMILES | CNC1CC(C(C(C1O)OC2C3C(C(C(O2)CO)O)OC4(O3)C(C(C(C(O4)C(CO)N)O)O)O)O)N |
| Synonym | hygromycin b |
| IUPAC Name | (3'S,3aS,4S,4'S,5'R,6R,6'R,7R,7aS)-4-[(1R,2S,3R,5S,6S)-3-amino-2,6-dihydroxy-5-(methylamino)cyclohexyl]oxy-6'-[(1S)-1-amino-2-hydroxyethyl]-6-(hydroxymethyl)spiro[4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-2,2'-oxane]-3',4',5',7-tetrol |
| InChI Key | GRRNUXAQVGOGFE-BBMONYMYSA-N |
| Molecular Formula | C20H37N3O13 |