Steroids and derivatives
Steroids and derivatives
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Résultats de la recherche filtrée
beta-Estradiol, 99% (dry wt.), ca 3% water, Thermo Scientific Chemicals
CAS: 50-28-2 Formule moléculaire: C18H24O2 Poids moléculaire (g/mol): 272.388 Numéro MDL: MFCD00003693 Clé InChI: VOXZDWNPVJITMN-ZBRFXRBCSA-N Synonyme: estradiol,beta-estradiol,17beta-estradiol,oestradiol,dihydrofolliculin,estrace,ovocyclin,progynon,dihydrotheelin,dihydroxyestrin CID PubChem: 5757 ChEBI: CHEBI:16469 Nom IUPAC: (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol SMILES: CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)O
Poids moléculaire (g/mol) | 272.388 |
---|---|
Synonyme | estradiol,beta-estradiol,17beta-estradiol,oestradiol,dihydrofolliculin,estrace,ovocyclin,progynon,dihydrotheelin,dihydroxyestrin |
Numéro MDL | MFCD00003693 |
CAS | 50-28-2 |
CID PubChem | 5757 |
ChEBI | CHEBI:16469 |
Nom IUPAC | (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol |
Clé InChI | VOXZDWNPVJITMN-ZBRFXRBCSA-N |
SMILES | CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)O |
Formule moléculaire | C18H24O2 |
Ecdysterone, Thermo Scientific Chemicals
CAS: 5289-74-7 Formule moléculaire: C27H44O7 Poids moléculaire (g/mol): 480.64 Numéro MDL: MFCD00036740 Clé InChI: NKDFYOWSKOHCCO-YPVLXUMRSA-N Synonyme: 20-hydroxyecdysone,ecdysterone,beta-ecdysone,crustecdysone,20-oh ecdysone,the-7,polypodine a,insect moulting hormone,commisterone,crustecdyson CID PubChem: 5459840 ChEBI: CHEBI:16587 Nom IUPAC: (1S,3aS,5aR,7R,8S,9aR,9bR,11aR)-3a,7,8-trihydroxy-9a,11a-dimethyl-1-[(2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl]-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-5-one SMILES: CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C
Poids moléculaire (g/mol) | 480.64 |
---|---|
Synonyme | 20-hydroxyecdysone,ecdysterone,beta-ecdysone,crustecdysone,20-oh ecdysone,the-7,polypodine a,insect moulting hormone,commisterone,crustecdyson |
Numéro MDL | MFCD00036740 |
CAS | 5289-74-7 |
CID PubChem | 5459840 |
ChEBI | CHEBI:16587 |
Nom IUPAC | (1S,3aS,5aR,7R,8S,9aR,9bR,11aR)-3a,7,8-trihydroxy-9a,11a-dimethyl-1-[(2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl]-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-5-one |
Clé InChI | NKDFYOWSKOHCCO-YPVLXUMRSA-N |
SMILES | CC(C)(O)CC[C@@H](O)[C@](C)(O)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@@H](O)[C@@H](O)C[C@]4(C)[C@H]3CC[C@]12C |
Formule moléculaire | C27H44O7 |
Fluorometholone 98.0+%, TCI America™
CAS: 426-13-1 Formule moléculaire: C22H29FO4 Poids moléculaire (g/mol): 376.468 Numéro MDL: MFCD00056461 Clé InChI: FAOZLTXFLGPHNG-KNAQIMQKSA-N Synonyme: fluorometholone,oxylone,flumetholon,fluormetholone,fml liquifilm,fluor-op,cortilet,delmeson,trilcin,fml forte CID PubChem: 9878 ChEBI: CHEBI:31625 Nom IUPAC: (6S,8S,9R,10S,11S,13S,14S,17R)-17-acetyl-9-fluoro-11,17-dihydroxy-6,10,13-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one SMILES: CC1CC2C3CCC(C3(CC(C2(C4(C1=CC(=O)C=C4)C)F)O)C)(C(=O)C)O
Poids moléculaire (g/mol) | 376.468 |
---|---|
Synonyme | fluorometholone,oxylone,flumetholon,fluormetholone,fml liquifilm,fluor-op,cortilet,delmeson,trilcin,fml forte |
Numéro MDL | MFCD00056461 |
CAS | 426-13-1 |
CID PubChem | 9878 |
ChEBI | CHEBI:31625 |
Nom IUPAC | (6S,8S,9R,10S,11S,13S,14S,17R)-17-acetyl-9-fluoro-11,17-dihydroxy-6,10,13-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one |
Clé InChI | FAOZLTXFLGPHNG-KNAQIMQKSA-N |
SMILES | CC1CC2C3CCC(C3(CC(C2(C4(C1=CC(=O)C=C4)C)F)O)C)(C(=O)C)O |
Formule moléculaire | C22H29FO4 |
Mifepristone, 98%, Thermo Scientific Chemicals
CAS: 84371-65-3 Formule moléculaire: C29H35NO2 Poids moléculaire (g/mol): 429.59 Clé InChI: VKHAHZOOUSRJNA-GCNJZUOMSA-N Synonyme: mifepristone,mifeprex,mifegyne,mifepriston,corlux,mifepristona,mifepristonum,korlym,mifepristonum latin,mifepristona spanish CID PubChem: 55245 ChEBI: CHEBI:50692 Nom IUPAC: (8S,11R,13S,14S,17S)-11-[4-(dimethylamino)phenyl]-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one SMILES: CC#CC1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)N(C)C)C)O
Poids moléculaire (g/mol) | 429.59 |
---|---|
Synonyme | mifepristone,mifeprex,mifegyne,mifepriston,corlux,mifepristona,mifepristonum,korlym,mifepristonum latin,mifepristona spanish |
CAS | 84371-65-3 |
CID PubChem | 55245 |
ChEBI | CHEBI:50692 |
Nom IUPAC | (8S,11R,13S,14S,17S)-11-[4-(dimethylamino)phenyl]-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one |
Clé InChI | VKHAHZOOUSRJNA-GCNJZUOMSA-N |
SMILES | CC#CC1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)N(C)C)C)O |
Formule moléculaire | C29H35NO2 |
Ethinylestradiol, 98%, Thermo Scientific Chemicals
CAS: 57-63-6 Formule moléculaire: C20H24O2 Poids moléculaire (g/mol): 296.41 Numéro MDL: MFCD00003690 Clé InChI: BFPYWIDHMRZLRN-SLHNCBLASA-N Synonyme: ethinyl estradiol,ethynylestradiol,ethynyl estradiol,ethinylestradiol,ethinyloestradiol,ginestrene,17-ethinylestradiol,progynon c,ethinoral,eticyclin CID PubChem: 5991 ChEBI: CHEBI:4903 Nom IUPAC: (8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol SMILES: C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1CC[C@@]2(O)C#C
Poids moléculaire (g/mol) | 296.41 |
---|---|
Synonyme | ethinyl estradiol,ethynylestradiol,ethynyl estradiol,ethinylestradiol,ethinyloestradiol,ginestrene,17-ethinylestradiol,progynon c,ethinoral,eticyclin |
Numéro MDL | MFCD00003690 |
CAS | 57-63-6 |
CID PubChem | 5991 |
ChEBI | CHEBI:4903 |
Nom IUPAC | (8R,9S,13S,14S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol |
Clé InChI | BFPYWIDHMRZLRN-SLHNCBLASA-N |
SMILES | C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1CC[C@@]2(O)C#C |
Formule moléculaire | C20H24O2 |
Mifepristone 98.0+%, TCI America™
CAS: 84371-65-3 Formule moléculaire: C29H35NO2 Poids moléculaire (g/mol): 429.604 Clé InChI: VKHAHZOOUSRJNA-GCNJZUOMSA-N Synonyme: mifepristone,mifeprex,mifegyne,mifepriston,corlux,mifepristona,mifepristonum,korlym,mifepristonum latin,mifepristona spanish CID PubChem: 55245 ChEBI: CHEBI:50692 Nom IUPAC: (8S,11R,13S,14S,17S)-11-[4-(dimethylamino)phenyl]-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one SMILES: CC#CC1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)N(C)C)C)O
Poids moléculaire (g/mol) | 429.604 |
---|---|
Synonyme | mifepristone,mifeprex,mifegyne,mifepriston,corlux,mifepristona,mifepristonum,korlym,mifepristonum latin,mifepristona spanish |
CAS | 84371-65-3 |
CID PubChem | 55245 |
ChEBI | CHEBI:50692 |
Nom IUPAC | (8S,11R,13S,14S,17S)-11-[4-(dimethylamino)phenyl]-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one |
Clé InChI | VKHAHZOOUSRJNA-GCNJZUOMSA-N |
SMILES | CC#CC1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)N(C)C)C)O |
Formule moléculaire | C29H35NO2 |
Thermo Scientific Chemicals Ouabain octahydrate, 96%
CAS: 11018-89-6 Formule moléculaire: C29H44O12·8H2O Poids moléculaire (g/mol): 728.78 Numéro MDL: MFCD00149240 Clé InChI: TYBARJRCFHUHSN-DMJRSANLSA-N Synonyme: ouabain octahydrate,strophantine octahydrate,quabain octahydrate,ouabain usp,penta a phenanthren-17-yl-2h-furan-5-one;octahydrate,gamma-strophanthin,3-1r,3s,5s,8r,9s,10r,11r,13r,14s,17r-1,5,11,14-tetrahydroxy-10-hydroxymethyl-13-methyl-3-2r,3r,4r,5r,6s-3,4,5-trihydroxy-6-methyloxan-2-yl oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1h-cyclo,prestwick_370,acocantherine;g-strophanthin CID PubChem: 6364534 Nom IUPAC: 3-[(1R,3S,5S,8R,9S,10R,11R,13R,14S,17R)-1,5,11,14-tetrahydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one;octahydrate SMILES: CC1C(C(C(C(O1)OC2CC(C3(C4C(CCC3(C2)O)C5(CCC(C5(CC4O)C)C6=CC(=O)OC6)O)CO)O)O)O)O.O.O.O.O.O.O.O.O
Poids moléculaire (g/mol) | 728.78 |
---|---|
Synonyme | ouabain octahydrate,strophantine octahydrate,quabain octahydrate,ouabain usp,penta a phenanthren-17-yl-2h-furan-5-one;octahydrate,gamma-strophanthin,3-1r,3s,5s,8r,9s,10r,11r,13r,14s,17r-1,5,11,14-tetrahydroxy-10-hydroxymethyl-13-methyl-3-2r,3r,4r,5r,6s-3,4,5-trihydroxy-6-methyloxan-2-yl oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1h-cyclo,prestwick_370,acocantherine;g-strophanthin |
Numéro MDL | MFCD00149240 |
CAS | 11018-89-6 |
CID PubChem | 6364534 |
Nom IUPAC | 3-[(1R,3S,5S,8R,9S,10R,11R,13R,14S,17R)-1,5,11,14-tetrahydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one;octahydrate |
Clé InChI | TYBARJRCFHUHSN-DMJRSANLSA-N |
SMILES | CC1C(C(C(C(O1)OC2CC(C3(C4C(CCC3(C2)O)C5(CCC(C5(CC4O)C)C6=CC(=O)OC6)O)CO)O)O)O)O.O.O.O.O.O.O.O.O |
Formule moléculaire | C29H44O12·8H2O |
Sodium taurocholate hydrate, 96%, Thermo Scientific Chemicals
CAS: 345909-26-4 Formule moléculaire: C26H44NNaO7S Poids moléculaire (g/mol): 537.688 Numéro MDL: MFCD00150819 Clé InChI: JAJWGJBVLPIOOH-VXFFEJGCSA-M Synonyme: sodium taurocholate,taurocholic acid sodium salt,taurocholate sodium,taurocholate sodium salt,unii-m6n3th81no,monosodium n-choloyltaurinate,m6n3th81no,monosodium taurocholate,sodium n-choloyltaurinate,monosodium taurocholic acid CID PubChem: 131632374 Nom IUPAC: sodium;2-[[(4R)-4-[(3R,5S,7R,8R,9R,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate SMILES: CC(CCC(=O)NCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C.[Na+]
Poids moléculaire (g/mol) | 537.688 |
---|---|
Synonyme | sodium taurocholate,taurocholic acid sodium salt,taurocholate sodium,taurocholate sodium salt,unii-m6n3th81no,monosodium n-choloyltaurinate,m6n3th81no,monosodium taurocholate,sodium n-choloyltaurinate,monosodium taurocholic acid |
Numéro MDL | MFCD00150819 |
CAS | 345909-26-4 |
CID PubChem | 131632374 |
Nom IUPAC | sodium;2-[[(4R)-4-[(3R,5S,7R,8R,9R,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate |
Clé InChI | JAJWGJBVLPIOOH-VXFFEJGCSA-M |
SMILES | CC(CCC(=O)NCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C.[Na+] |
Formule moléculaire | C26H44NNaO7S |
Thermo Scientific Chemicals Vitamin D3, 99%
CAS: 67-97-0 Formule moléculaire: C27H44O Poids moléculaire (g/mol): 384.648 Numéro MDL: MFCD00078131 Clé InChI: QYSXJUFSXHHAJI-YRZJJWOYSA-N Synonyme: vitamin d3,cholecalciferol,calciol,colecalciferol,oleovitamin d3,arachitol,activated 7-dehydrocholesterol,vitamin d,colecalcipherol,colecalciferolum CID PubChem: 5280795 ChEBI: CHEBI:28940 Nom IUPAC: (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol SMILES: CC(C)CCCC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C
Poids moléculaire (g/mol) | 384.648 |
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Synonyme | vitamin d3,cholecalciferol,calciol,colecalciferol,oleovitamin d3,arachitol,activated 7-dehydrocholesterol,vitamin d,colecalcipherol,colecalciferolum |
Numéro MDL | MFCD00078131 |
CAS | 67-97-0 |
CID PubChem | 5280795 |
ChEBI | CHEBI:28940 |
Nom IUPAC | (1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol |
Clé InChI | QYSXJUFSXHHAJI-YRZJJWOYSA-N |
SMILES | CC(C)CCCC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C |
Formule moléculaire | C27H44O |
Numéro MDL | MFCD00868110 |
---|---|
CAS | 4468-02-4 |
5-Amino-2-methylbenzenesulfonamide, 96%, Thermo Scientific Chemicals
CAS: 6973-09-7 Numéro MDL: MFCD06681071 ChEBI: CHEBI:29013
Numéro MDL | MFCD06681071 |
---|---|
CAS | 6973-09-7 |
ChEBI | CHEBI:29013 |
Hydrocortisone acetate, 97+%, Thermo Scientific Chemicals
CAS: 50-03-3 Formule moléculaire: C23H32O6 Poids moléculaire (g/mol): 404.50 Numéro MDL: MFCD00037714 Clé InChI: ALEXXDVDDISNDU-JZYPGELDSA-N Synonyme: hydrocortisone acetate,cortell,cortisol 21-acetate,cortisol acetate,cortacream,hydrocortisat,abbocort,bambicort,biocortar,chemysone CID PubChem: 5744 ChEBI: CHEBI:17609 SMILES: CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C
Poids moléculaire (g/mol) | 404.50 |
---|---|
Synonyme | hydrocortisone acetate,cortell,cortisol 21-acetate,cortisol acetate,cortacream,hydrocortisat,abbocort,bambicort,biocortar,chemysone |
Numéro MDL | MFCD00037714 |
CAS | 50-03-3 |
CID PubChem | 5744 |
ChEBI | CHEBI:17609 |
Clé InChI | ALEXXDVDDISNDU-JZYPGELDSA-N |
SMILES | CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C |
Formule moléculaire | C23H32O6 |
Beclometasone Dipropionate 98.0+%, TCI America™
CAS: 5534-09-8 Formule moléculaire: C28H37ClO7 Poids moléculaire (g/mol): 521.05 Numéro MDL: MFCD00135613 Clé InChI: KUVIULQEHSCUHY-XYWKZLDCSA-N Synonyme: beclomethasone dipropionate,beclometasone dipropionate,beconase,beclovent,vancenase,beclazone,becloforte,beclomet,beclorhinol,propaderm CID PubChem: 134129500 Nom IUPAC: [2-[(8R,10S,11S,13S,14S,16S,17R)-9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propanoyloxy-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate SMILES: CCC(=O)OCC(=O)C1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)Cl)O)C)C)OC(=O)CC
Poids moléculaire (g/mol) | 521.05 |
---|---|
Synonyme | beclomethasone dipropionate,beclometasone dipropionate,beconase,beclovent,vancenase,beclazone,becloforte,beclomet,beclorhinol,propaderm |
Numéro MDL | MFCD00135613 |
CAS | 5534-09-8 |
CID PubChem | 134129500 |
Nom IUPAC | [2-[(8R,10S,11S,13S,14S,16S,17R)-9-chloro-11-hydroxy-10,13,16-trimethyl-3-oxo-17-propanoyloxy-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate |
Clé InChI | KUVIULQEHSCUHY-XYWKZLDCSA-N |
SMILES | CCC(=O)OCC(=O)C1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)Cl)O)C)C)OC(=O)CC |
Formule moléculaire | C28H37ClO7 |
Calcitriol 97.0+%, TCI America™
CAS: 32222-06-3 Formule moléculaire: C27H44O3 Poids moléculaire (g/mol): 416.65 Numéro MDL: MFCD00867079,MFCD11656129 Clé InChI: GMRQFYUYWCNGIN-NKMMMXOESA-N Synonyme: calcitriol,rocaltrol,calcijex,topitriol,1alpha,25-dihydroxyvitamin d3,silkis,soltriol,1alpha,25-dihydroxycholecalciferol,calcitriolum,dihydroxyvitamin d3 CID PubChem: 5280453 ChEBI: CHEBI:17823 Nom IUPAC: (1R,3S,5Z)-5-{2-[(1R,3aS,4E,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol SMILES: C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)C[C@H](O)C1=C
Poids moléculaire (g/mol) | 416.65 |
---|---|
Synonyme | calcitriol,rocaltrol,calcijex,topitriol,1alpha,25-dihydroxyvitamin d3,silkis,soltriol,1alpha,25-dihydroxycholecalciferol,calcitriolum,dihydroxyvitamin d3 |
Numéro MDL | MFCD00867079,MFCD11656129 |
CAS | 32222-06-3 |
CID PubChem | 5280453 |
ChEBI | CHEBI:17823 |
Nom IUPAC | (1R,3S,5Z)-5-{2-[(1R,3aS,4E,7aR)-1-[(2R)-6-hydroxy-6-methylheptan-2-yl]-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol |
Clé InChI | GMRQFYUYWCNGIN-NKMMMXOESA-N |
SMILES | C[C@H](CCCC(C)(C)O)[C@H]1CC[C@H]2\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)C[C@H](O)C1=C |
Formule moléculaire | C27H44O3 |
Cortexolone 98.0+%, TCI America™
CAS: 152-58-9 Formule moléculaire: C21H30O4 Poids moléculaire (g/mol): 346.467 Numéro MDL: MFCD00003662 Clé InChI: WHBHBVVOGNECLV-OBQKJFGGSA-N Synonyme: cortexolone,cortodoxone,11-deoxycortisol,11-desoxycortisol,reichstein's substance s,cortisol, 11-deoxy,17,21-dihydroxypregn-4-ene-3,20-dione,reichstein s,substance s,pregn-4-ene-3,20-dione, 17,21-dihydroxy CID PubChem: 440707 ChEBI: CHEBI:28324 Nom IUPAC: (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one SMILES: CC12CCC(=O)C=C1CCC3C2CCC4(C3CCC4(C(=O)CO)O)C
Poids moléculaire (g/mol) | 346.467 |
---|---|
Synonyme | cortexolone,cortodoxone,11-deoxycortisol,11-desoxycortisol,reichstein's substance s,cortisol, 11-deoxy,17,21-dihydroxypregn-4-ene-3,20-dione,reichstein s,substance s,pregn-4-ene-3,20-dione, 17,21-dihydroxy |
Numéro MDL | MFCD00003662 |
CAS | 152-58-9 |
CID PubChem | 440707 |
ChEBI | CHEBI:28324 |
Nom IUPAC | (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one |
Clé InChI | WHBHBVVOGNECLV-OBQKJFGGSA-N |
SMILES | CC12CCC(=O)C=C1CCC3C2CCC4(C3CCC4(C(=O)CO)O)C |
Formule moléculaire | C21H30O4 |