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CHEBI:192102 - 16-a-Hydroxypregnenolone

ChEBI IDCHEBI:192102
ChEBI Name16-a-Hydroxypregnenolone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H32O3
Net Charge0
Average Mass332.484
Monoisotopic Mass332.23514
SMILESCC(=O)C1C(O)CC2C3CC=C4CC(O)CC[C@]4(C)C3CC[C@@]21C
InChIInChI=1S/C21H32O3/c1-12(22)19-18(24)11-17-15-5-4-13-10-14(23)6-8-20(13,2)16(15)7-9-21(17,19)3/h4,14-19,23-24H,5-11H2,1-3H3/t14?,15?,16?,17?,18?,19?,20-,21-/m0/s1
InChIKeyZAKJZPQDUPCXSD-KAJYYJDKSA-N
Species of MetaboliteComponentSourceComments
Marine plankton environmental sample (ncbitaxon:632957) - MetaboLights (MTBLS4424) Found in endometabolome.
Roles Classification
Biological Role:
hormone  Originally referring to an endogenous compound that is formed in specialized organ or group of cells and carried to another organ or group of cells, in the same organism, upon which it has a specific regulatory function, the term is now commonly used to include non-endogenous, semi-synthetic and fully synthetic analogues of such compounds.
ChEBI Ontology
Outgoing Relation(s)
16-a-Hydroxypregnenolone (CHEBI:192102) is a corticosteroid hormone (CHEBI:36699)
IUPAC Name 
1-[(10R,13S)-3,16-dihydroxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone