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Steroids and derivatives

Any of a large class of organic compounds with a characteristic molecular structure containing four rings of carbon atoms (three six-membered and one five) and associated derivatives; includes many hormones, alkaloids, and vitamins.
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Keyword Search:
1 – 15 of 81 results
1
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Sodium cholate hydrate, 99%, Thermo Scientific Chemicals

CAS: 206986-87-0 Molecular Formula: C24H39NaO5 Molecular Weight (g/mol): 430.56 MDL Number: MFCD00064138 MFCD00003672 InChI Key: NRHMKIHPTBHXPF-TUJRSCDTSA-M PubChem CID: 23679061 IUPAC Name: sodium;(4R)-4-[(3R,5S,7R,8R,9S,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]pentanoate;hydrate SMILES: [Na+].[H][C@@]12CC[C@H]([C@H](C)CCC([O-])=O)[C@@]1(C)[C@@H](O)C[C@@]1([H])[C@@]2([H])[C@H](O)C[C@]2([H])C[C@H](O)CC[C@]12C

PubChem CID 23679061
CAS 206986-87-0
Molecular Weight (g/mol) 430.56
MDL Number MFCD00064138 MFCD00003672
SMILES [Na+].[H][C@@]12CC[C@H]([C@H](C)CCC([O-])=O)[C@@]1(C)[C@@H](O)C[C@@]1([H])[C@@]2([H])[C@H](O)C[C@]2([H])C[C@H](O)CC[C@]12C
IUPAC Name sodium;(4R)-4-[(3R,5S,7R,8R,9S,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]pentanoate;hydrate
InChI Key NRHMKIHPTBHXPF-TUJRSCDTSA-M
Molecular Formula C24H39NaO5
2
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5alpha-Cholestane, 98+%

CAS: 481-21-0 Molecular Formula: C27H48 Molecular Weight (g/mol): 372.67 MDL Number: MFCD00066412 InChI Key: XIIAYQZJNBULGD-XWLABEFZSA-N Synonym: 5alpha-cholestane,5-alpha-cholestane,alpha-cholestane,cholestane,28,29,30-trinorlanostane,unii-u260hwn305,5alpha-cholestane 8ci,5?-cholestane,cholestane van PubChem CID: 2723895 ChEBI: CHEBI:35515 IUPAC Name: (5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCCC4)C)C

PubChem CID 2723895
CAS 481-21-0
Molecular Weight (g/mol) 372.67
ChEBI CHEBI:35515
MDL Number MFCD00066412
SMILES CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCCC4)C)C
Synonym 5alpha-cholestane,5-alpha-cholestane,alpha-cholestane,cholestane,28,29,30-trinorlanostane,unii-u260hwn305,5alpha-cholestane 8ci,5?-cholestane,cholestane van
IUPAC Name (5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene
InChI Key XIIAYQZJNBULGD-XWLABEFZSA-N
Molecular Formula C27H48
3
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Mifepristone, 98%, Thermo Scientific Chemicals

CAS: 84371-65-3 Molecular Formula: C29H35NO2 Molecular Weight (g/mol): 429.59 InChI Key: VKHAHZOOUSRJNA-GCNJZUOMSA-N Synonym: mifepristone,mifeprex,mifegyne,mifepriston,corlux,mifepristona,mifepristonum,korlym,mifepristonum latin,mifepristona spanish PubChem CID: 55245 ChEBI: CHEBI:50692 IUPAC Name: (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

PubChem CID 55245
CAS 84371-65-3
Molecular Weight (g/mol) 429.59
ChEBI CHEBI:50692
SMILES CC#CC1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC=C(C=C5)N(C)C)C)O
Synonym mifepristone,mifeprex,mifegyne,mifepriston,corlux,mifepristona,mifepristonum,korlym,mifepristonum latin,mifepristona spanish
IUPAC Name (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
InChI Key VKHAHZOOUSRJNA-GCNJZUOMSA-N
Molecular Formula C29H35NO2
4

Triamcinolone acetonide, 98+%, Thermo Scientific Chemicals

CAS: 76-25-5 Molecular Formula: C24H31FO6 Molecular Weight (g/mol): 434.504 MDL Number: MFCD00056834 InChI Key: YNDXUCZADRHECN-JNQJZLCISA-N Synonym: triamcinolone acetonide,azmacort,nasacort aq,aristoderm,aristogel,kenalone,solodelf,tramacin,triaceton,tricinolon PubChem CID: 6436 ChEBI: CHEBI:71418 SMILES: CC1(OC2CC3C4CCC5=CC(=O)C=CC5(C4(C(CC3(C2(O1)C(=O)CO)C)O)F)C)C

PubChem CID 6436
CAS 76-25-5
Molecular Weight (g/mol) 434.504
ChEBI CHEBI:71418
MDL Number MFCD00056834
SMILES CC1(OC2CC3C4CCC5=CC(=O)C=CC5(C4(C(CC3(C2(O1)C(=O)CO)C)O)F)C)C
Synonym triamcinolone acetonide,azmacort,nasacort aq,aristoderm,aristogel,kenalone,solodelf,tramacin,triaceton,tricinolon
InChI Key YNDXUCZADRHECN-JNQJZLCISA-N
Molecular Formula C24H31FO6
5

11-Deoxycorticosterone acetate, 97%, Thermo Scientific Chemicals

CAS: 56-47-3 Molecular Formula: C23H32O4 Molecular Weight (g/mol): 372.51 MDL Number: MFCD00003660 InChI Key: VPGRYOFKCNULNK-ZIUYWEQENA-N Synonym: deoxycorticosterone acetate,desoxycorticosterone acetate,doca,desoxycortone acetate,percotol,cortexone acetate,decosteron,decosterone,sincortex,syncortyl PubChem CID: 5952 ChEBI: CHEBI:34671 SMILES: [H][C@@]12CC[C@H](C(=O)COC(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C

PubChem CID 5952
CAS 56-47-3
Molecular Weight (g/mol) 372.51
ChEBI CHEBI:34671
MDL Number MFCD00003660
SMILES [H][C@@]12CC[C@H](C(=O)COC(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C
Synonym deoxycorticosterone acetate,desoxycorticosterone acetate,doca,desoxycortone acetate,percotol,cortexone acetate,decosteron,decosterone,sincortex,syncortyl
InChI Key VPGRYOFKCNULNK-ZIUYWEQENA-N
Molecular Formula C23H32O4
6
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Thermo Scientific Chemicals Levonorgestrel, 98%

CAS: 797-63-7 Molecular Formula: C21H28O2 Molecular Weight (g/mol): 312.45 InChI Key: WWYNJERNGUHSAO-XUDSTZEESA-N Synonym: levonorgestrel,norgestrel,d-norgestrel,--norgestrel,levonova,microval,postinor,mirena,plan b,jadelle PubChem CID: 13109 ChEBI: CHEBI:6443 IUPAC Name: (8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-17-hydroxy-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one SMILES: CCC12CCC3C(C1CCC2(C#C)O)CCC4=CC(=O)CCC34

PubChem CID 13109
CAS 797-63-7
Molecular Weight (g/mol) 312.45
ChEBI CHEBI:6443
SMILES CCC12CCC3C(C1CCC2(C#C)O)CCC4=CC(=O)CCC34
Synonym levonorgestrel,norgestrel,d-norgestrel,--norgestrel,levonova,microval,postinor,mirena,plan b,jadelle
IUPAC Name (8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-17-hydroxy-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
InChI Key WWYNJERNGUHSAO-XUDSTZEESA-N
Molecular Formula C21H28O2
7
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Estriol, 97%, Thermo Scientific Chemicals

CAS: 50-27-1 Molecular Formula: C18H24O3 Molecular Weight (g/mol): 288.38 InChI Key: PROQIPRRNZUXQM-ZXXIGWHRSA-N Synonym: estriol,oestriol,estratriol,ovestin,ovestrion,trihydroxyestrin,destriol,tridestrin,aacifemine,oestratriol PubChem CID: 5756 ChEBI: CHEBI:27974 IUPAC Name: (8R,9S,13S,14S,16R,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol SMILES: CC12CCC3C(C1CC(C2O)O)CCC4=C3C=CC(=C4)O

PubChem CID 5756
CAS 50-27-1
Molecular Weight (g/mol) 288.38
ChEBI CHEBI:27974
SMILES CC12CCC3C(C1CC(C2O)O)CCC4=C3C=CC(=C4)O
Synonym estriol,oestriol,estratriol,ovestin,ovestrion,trihydroxyestrin,destriol,tridestrin,aacifemine,oestratriol
IUPAC Name (8R,9S,13S,14S,16R,17R)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol
InChI Key PROQIPRRNZUXQM-ZXXIGWHRSA-N
Molecular Formula C18H24O3
8

Canrenone, 98%

CAS: 976-71-6 Molecular Formula: C22H28O3 Molecular Weight (g/mol): 340.463 MDL Number: MFCD00071735 InChI Key: UJVLDDZCTMKXJK-WNHSNXHDSA-N Synonym: canrenone,aldadiene,phanurane,luvion,aldadiene van,canrenone usan:inn,canrenonum inn-latin,canrenona inn-spanish,unii-78o20x9j0u,17alpha-2-carboxyethyl-17beta-hydroxyandrosta-4,6-dien-3-one lactone PubChem CID: 13789 IUPAC Name: (8R,9S,10R,13S,14S,17R)-10,13-dimethylspiro[2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione SMILES: CC12CCC(=O)C=C1C=CC3C2CCC4(C3CCC45CCC(=O)O5)C

PubChem CID 13789
CAS 976-71-6
Molecular Weight (g/mol) 340.463
MDL Number MFCD00071735
SMILES CC12CCC(=O)C=C1C=CC3C2CCC4(C3CCC45CCC(=O)O5)C
Synonym canrenone,aldadiene,phanurane,luvion,aldadiene van,canrenone usan:inn,canrenonum inn-latin,canrenona inn-spanish,unii-78o20x9j0u,17alpha-2-carboxyethyl-17beta-hydroxyandrosta-4,6-dien-3-one lactone
IUPAC Name (8R,9S,10R,13S,14S,17R)-10,13-dimethylspiro[2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,5'-oxolane]-2',3-dione
InChI Key UJVLDDZCTMKXJK-WNHSNXHDSA-N
Molecular Formula C22H28O3
9
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Zinc gluconate hydrate, 97%

CAS: 4468-02-4 MDL Number: MFCD00868110

CAS 4468-02-4
MDL Number MFCD00868110
10

Chenodeoxycholic Acid, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

11
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Ethinylestradiol, 98%, Thermo Scientific Chemicals

CAS: 57-63-6 Molecular Formula: C20H24O2 Molecular Weight (g/mol): 296.41 MDL Number: MFCD00003690 InChI Key: BFPYWIDHMRZLRN-SLHNCBLASA-N Synonym: ethinyl estradiol,ethynylestradiol,ethynyl estradiol,ethinylestradiol,ethinyloestradiol,ginestrene,17-ethinylestradiol,progynon c,ethinoral,eticyclin PubChem CID: 5991 ChEBI: CHEBI:4903 IUPAC Name: (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

PubChem CID 5991
CAS 57-63-6
Molecular Weight (g/mol) 296.41
ChEBI CHEBI:4903
MDL Number MFCD00003690
SMILES C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1CC[C@@]2(O)C#C
Synonym ethinyl estradiol,ethynylestradiol,ethynyl estradiol,ethinylestradiol,ethinyloestradiol,ginestrene,17-ethinylestradiol,progynon c,ethinoral,eticyclin
IUPAC Name (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
InChI Key BFPYWIDHMRZLRN-SLHNCBLASA-N
Molecular Formula C20H24O2
12

Thermo Scientific Chemicals Estradiene dione

CAS: 5571-36-8 Molecular Formula: C20H26O3 Molecular Weight (g/mol): 314.43 InChI Key: XUOQKQRMICQUQC-UHFFFAOYNA-N IUPAC Name: 11a-methyl-1,2,3,3a,3b,4,5,6,8,9,11,11a-dodecahydrospiro[cyclopenta[a]phenanthrene-7,2'-[1,3]dioxolan]-1-one SMILES: CC12CC=C3C(CCC4=C3CCC3(C4)OCCO3)C1CCC2=O

CAS 5571-36-8
Molecular Weight (g/mol) 314.43
SMILES CC12CC=C3C(CCC4=C3CCC3(C4)OCCO3)C1CCC2=O
IUPAC Name 11a-methyl-1,2,3,3a,3b,4,5,6,8,9,11,11a-dodecahydrospiro[cyclopenta[a]phenanthrene-7,2'-[1,3]dioxolan]-1-one
InChI Key XUOQKQRMICQUQC-UHFFFAOYNA-N
Molecular Formula C20H26O3
13

Thermo Scientific Chemicals Megestrol acetate

CAS: 595-33-5 Molecular Weight (g/mol): 384.52 InChI Key: RQZAXGRLVPAYTJ-GQFGMJRRSA-N IUPAC Name: (1R,3aS,3bR,9aR,9bS,11aS)-1-acetyl-5,9a,11a-trimethyl-7-oxo-1H,2H,3H,3aH,3bH,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl acetate SMILES: CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=O

CAS 595-33-5
Molecular Weight (g/mol) 384.52
SMILES CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)=O
IUPAC Name (1R,3aS,3bR,9aR,9bS,11aS)-1-acetyl-5,9a,11a-trimethyl-7-oxo-1H,2H,3H,3aH,3bH,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl acetate
InChI Key RQZAXGRLVPAYTJ-GQFGMJRRSA-N
14
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Dexamethasone, 98%

CAS: 50-02-2 Molecular Formula: C22H29FO5 Molecular Weight (g/mol): 392.47 MDL Number: MFCD00064136 InChI Key: UREBDLICKHMUKA-CXSFZGCWSA-N Synonym: dexamethasone,decadron,dexamethazone,maxidex,decaspray,desametasone,hexadecadrol,dexacort,dexasone,hexadrol PubChem CID: 5743 ChEBI: CHEBI:41879 IUPAC Name: (1R,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b-fluoro-1,10-dihydroxy-1-(2-hydroxyacetyl)-2,9a,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one SMILES: C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO

PubChem CID 5743
CAS 50-02-2
Molecular Weight (g/mol) 392.47
ChEBI CHEBI:41879
MDL Number MFCD00064136
SMILES C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
Synonym dexamethasone,decadron,dexamethazone,maxidex,decaspray,desametasone,hexadecadrol,dexacort,dexasone,hexadrol
IUPAC Name (1R,2R,3aS,3bS,9aS,9bR,10S,11aS)-9b-fluoro-1,10-dihydroxy-1-(2-hydroxyacetyl)-2,9a,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
InChI Key UREBDLICKHMUKA-CXSFZGCWSA-N
Molecular Formula C22H29FO5
15
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Hydrocortisone acetate, 97+%

CAS: 50-03-3 Molecular Formula: C23H32O6 Molecular Weight (g/mol): 404.50 MDL Number: MFCD00037714 InChI Key: ALEXXDVDDISNDU-JZYPGELDSA-N Synonym: hydrocortisone acetate,cortell,cortisol 21-acetate,cortisol acetate,cortacream,hydrocortisat,abbocort,bambicort,biocortar,chemysone PubChem CID: 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

PubChem CID 5744
CAS 50-03-3
Molecular Weight (g/mol) 404.50
ChEBI CHEBI:17609
MDL Number MFCD00037714
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
Synonym hydrocortisone acetate,cortell,cortisol 21-acetate,cortisol acetate,cortacream,hydrocortisat,abbocort,bambicort,biocortar,chemysone
InChI Key ALEXXDVDDISNDU-JZYPGELDSA-N
Molecular Formula C23H32O6