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CHEBI:16076 - 11α-hydroxyprogesterone

ChEBI IDCHEBI:16076
ChEBI Name11α-hydroxyprogesterone
Stars
ASCII Name11alpha-hydroxyprogesterone
DefinitionA 11α-hydroxy steroid that is pregn-4-ene-3,20-dione substituted by a hydroxy group at position 11.
Secondary ChEBI IDsCHEBI:731, CHEBI:11315, CHEBI:19128
Last Modified13 November 2017
DownloadsMolfile
FormulaC21H30O3
Net Charge0
Average Mass330.468
Monoisotopic Mass330.21949
SMILES[H][C@@]12CCC3=CC(=O)CC[C@]3(C)[C@@]1([H])[C@H](O)C[C@]1(C)[C@@H](C(C)=O)CC[C@@]21[H]
InChIInChI=1S/C21H30O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h10,15-19,24H,4-9,11H2,1-3H3/t15-,16+,17-,18+,19+,20-,21+/m0/s1
InChIKeyBFZHCUBIASXHPK-QJSKAATBSA-N
ChEBI Ontology
Outgoing Relation(s)
11α-hydroxyprogesterone (CHEBI:16076) has functional parent progesterone (CHEBI:17026)
11α-hydroxyprogesterone (CHEBI:16076) is a 11α-hydroxy steroid (CHEBI:19129)
11α-hydroxyprogesterone (CHEBI:16076) is a 20-oxo steroid (CHEBI:36885)
11α-hydroxyprogesterone (CHEBI:16076) is a 3-oxo-Δ4 steroid (CHEBI:47909)
Incoming Relation(s)
11α-hydroxyprogesterone 11-glucosiduronic acid (CHEBI:62672) has functional parent 11α-hydroxyprogesterone (CHEBI:16076)
11α-hydroxyprogesterone hemisuccinate (CHEBI:45496) has functional parent 11α-hydroxyprogesterone (CHEBI:16076)
IUPAC Name 
11α-hydroxypregn-4-ene-3,20-dione
Synonyms  Source
11alpha-HydroxyprogesteroneKEGG COMPOUND
4-pregnen-11α-ol-3,20-dioneNIST Chemistry WebBook
(11α)-11-hydroxypregn-4-ene-3,20-dioneChemIDplus
UniProt Name  Source
11α-hydroxyprogesteroneUniProt
Manual XrefsDatabases
C03747KEGG COMPOUND
HMDB0000920HMDB
LMST02030184LIPID MAPS
Registry NumbersSources
Reaxys:2224223Reaxys
CAS:80-75-1KEGG COMPOUND
CAS:80-75-1NIST Chemistry WebBook
CAS:80-75-1ChemIDplus
Citations