Steroids and derivatives
Prednisolone, 99%, Thermo Scientific Chemicals
CAS: 50-24-8 Molecular Formula: C21H28O5 Molecular Weight (g/mol): 360.44 InChI Key: OIGNJSKKLXVSLS-VWUMJDOOSA-N Synonym: prednisolone,metacortandralone,hydroretrocortine,predonine,deltacortril,meticortelone,deltahydrocortisone,prenolone,hydroretrocortin,delta-cortef PubChem CID: 5755 ChEBI: CHEBI:8378 IUPAC Name: (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one SMILES: CC12CC(C3C(C1CCC2(C(=O)CO)O)CCC4=CC(=O)C=CC34C)O
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
Prednisone, Anhydrous, Micronized, USP, 97-102%, Spectrum™ Chemical
CAS: 53-03-2 Molecular Formula: C21H26O5 Molecular Weight (g/mol): 358.43 InChI Key: XOFYZVNMUHMLCC-ZPOLXVRWSA-N IUPAC Name: (1R,3aS,3bS,9aR,9bS,11aS)-1-hydroxy-1-(2-hydroxyacetyl)-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-7,10-dione SMILES: C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO
Fluorometholone, 97%, Thermo Scientific Chemicals
CAS: 426-13-1 Molecular Formula: C22H29FO4 Molecular Weight (g/mol): 376.46 InChI Key: FAOZLTXFLGPHNG-KNAQIMQKSA-N Synonym: fluorometholone,oxylone,flumetholon,fluormetholone,fml liquifilm,fluor-op,cortilet,delmeson,trilcin,fml forte PubChem CID: 9878 ChEBI: CHEBI:31625 IUPAC Name: (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
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
Cyproterone acetate, 98%, Thermo Scientific Chemicals
CAS: 427-51-0 Molecular Formula: C24H29ClO4 Molecular Weight (g/mol): 416.94 InChI Key: UWFYSQMTEOIJJG-FDTZYFLXSA-N Synonym: cyproterone acetate,androcur,cyproterone 17-o-acetate,cyproteron acetate,cyproteron-r acetate,cyprosterone acetate,unii-4km2bn5jhf,cyproteroneacetate,cyproterone 17alpha-acetate,ccris 4385 PubChem CID: 9880 ChEBI: CHEBI:50743 SMILES: CC(=O)C1(CCC2C1(CCC3C2C=C(C4=CC(=O)C5CC5C34C)Cl)C)OC(=O)C
Hydrocortisone, ≥97%, MP Biomedicals™
CAS: 50-23-7 Molecular Formula: C21H30O5 Molecular Weight (g/mol): 362.466 MDL Number: MFCD00011654 InChI Key: JYGXADMDTFJGBT-VWUMJDOOSA-N Synonym: hydrocortisone,cortisol,acticort,cetacort,cortef,17-hydroxycorticosterone,hydrocortisyl,hydrasson,cobadex,cortril PubChem CID: 5754 ChEBI: CHEBI:17650 IUPAC Name: (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-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=C1CCC3C2C(CC4(C3CCC4(C(=O)CO)O)C)O
β-Estradiol-3-Benzoate, 99.7%, MP Biomedicals™
CAS: 50-50-0 Molecular Formula: C25H28O3 Molecular Weight (g/mol): 376.496 MDL Number: MFCD00003692 InChI Key: UYIFTLBWAOGQBI-BZDYCCQFSA-N Synonym: estradiol benzoate,estradiol monobenzoate,benzhormovarine,benzoestrofol,benovocylin,benzofoline,follidrin,ovasterol-b,benzo-gynoestryl,primogyn b PubChem CID: 222757 ChEBI: CHEBI:77006 IUPAC Name: [(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate SMILES: CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5
Methyl cholate, 97%
CAS: 1448-36-8 Molecular Formula: C25H42O5 Molecular Weight (g/mol): 422.606 MDL Number: MFCD00064934 InChI Key: DLYVTEULDNMQAR-BSEHQKOQSA-N Synonym: Cholic acid methyl ester PubChem CID: 133124937 IUPAC Name: methyl (4S)-4-[(3R,7S,8S,9R,10R,12R,13S,14R,17S)-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 SMILES: CC(CCC(=O)OC)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
Cholic acid, 97%, Thermo Scientific Chemicals
CAS: 81-25-4 Molecular Formula: C24H40O5 Molecular Weight (g/mol): 408.579 MDL Number: MFCD00003672 InChI Key: BHQCQFFYRZLCQQ-OELDTZBJSA-N Synonym: cholic acid,cholalic acid,cholate,cholalin,colalin,cholsaeure,cholbam,cholicacid,cholic acid, 5beta,3alpha,7alpha,12alpha-trihydroxy-5beta-cholanic acid PubChem CID: 221493 ChEBI: CHEBI:16359 IUPAC Name: (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]pentanoic acid SMILES: CC(CCC(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
Limonin, >99.6%, For HPLC analysis, MP Biomedicals™
CAS: 1180-71-8 Molecular Formula: C26H30O8 Molecular Weight (g/mol): 470.52 MDL Number: MFCD00075922 InChI Key: KBDSLGBFQAGHBE-MSGMIQHVSA-N PubChem CID: 179651 ChEBI: CHEBI:16226 IUPAC Name: (1R,2R,7S,10R,13R,14R,16S,19S,20S)-19-(furan-3-yl)-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.0²,⁷.0²,¹⁰.0¹⁴,¹⁶.0¹⁴,²⁰]docosane-5,12,17-trione SMILES: CC1(C)O[C@H]2CC(=O)OC[C@@]22[C@H]1CC(=O)[C@]1(C)[C@@H]2CC[C@@]2(C)[C@@H](OC(=O)[C@H]3O[C@@]123)C1=COC=C1
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
Thermo Scientific Chemicals Ouabain octahydrate, 96%
CAS: 11018-89-6 Molecular Formula: C29H44O12·8H2O Molecular Weight (g/mol): 728.78 MDL Number: MFCD00149240 InChI Key: TYBARJRCFHUHSN-DMJRSANLSA-N Synonym: 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 PubChem CID: 6364534 IUPAC Name: 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
β-Estradiol, MP Biomedicals™
CAS: 50-28-2 Molecular Formula: C18H24O2 Molecular Weight (g/mol): 272.388 InChI Key: VOXZDWNPVJITMN-ZBRFXRBCSA-N Synonym: estradiol,beta-estradiol,17beta-estradiol,oestradiol,dihydrofolliculin,estrace,ovocyclin,progynon,dihydrotheelin,dihydroxyestrin PubChem CID: 5757 ChEBI: CHEBI:16469 IUPAC Name: (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