21-Hydroxypregnenolone

• 21-Hydroxypregnenolone
• bmse000749 - data

InCHi String:
InChI=1S/C21H32O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h3,14-18,22-23H,4-12H2,1-2H3

canonical and isomeric SMILES:
CC12CCC3C(C1CCC2C(=O)CO)CC=C4C3(CCC(C4)O)C


PUBCHEM iupac NAME: PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac CAS NAME
2-hydroxy-1-(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)ethanone

PUBCHEM iupac SYSTEMATIC NAME
1-(10,13-dimethyl-3-oxidanyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxidanyl-ethanone



PubChem Substance (SID):   80769170   7845
PubChem Compound (CID):   440705
KEGG: Compound ID   C05485
CAS Registry IDs:   1164-98-3
PDB Chemical Component   n/a
Miscellaneous Databases and IDs:   MMCD cq_03080   NextBio 440705