7alpha-hydroxypregnenolone (CHEBI:81467)

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CHEBI:81467 - 7α-hydroxypregnenolone

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ChEBI ID	CHEBI:81467
ChEBI Name	7α-hydroxypregnenolone
Stars
ASCII Name	7alpha-hydroxypregnenolone
Definition	A 20-oxo steroid that is pregnenolone carrying an additional hydroxy substituent at the 7α-position.
Last Modified	11 April 2018
Downloads	Molfile

Formula	C21H32O3
Net Charge	0
Average Mass	332.484
Monoisotopic Mass	332.23514
SMILES	[H][C@]12CC[C@]3(C)[C@@H](C(C)=O)CC[C@@]3([H])[C@]1([H])[C@H](O)C=C1C[C@@H](O)CC[C@@]12C
InChI	InChI=1S/C21H32O3/c1-12(22)15-4-5-16-19-17(7-9-21(15,16)3)20(2)8-6-14(23)10-13(20)11-18(19)24/h11,14-19,23-24H,4-10H2,1-3H3/t14-,15+,16-,17-,18+,19-,20-,21+/m0/s1
InChIKey	UEWNVBNIVGLQPG-XXHSLLPRSA-N

Species of Metabolite	Component	Source	Comments
Coturnix japonica (ncbitaxon:93934)	-	PubMed (19362555)
Cynops pyrrhogaster (ncbitaxon:8330)	-	PubMed (19456338)
Ictalurus punctatus (ncbitaxon:7998)	-	PubMed (9679086)
Oncorhynchus mykiss (ncbitaxon:8022)	-	PubMed (12714005)
Petromyzon marinus (ncbitaxon:7757)	-	PubMed (15193266)

Roles Classification

Biological Roles:	rat metabolite Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus). marine metabolite Any metabolite produced during a metabolic reaction in marine macro- and microorganisms. dopaminergic agent A drug used for its effects on dopamine receptors, on the life cycle of dopamine, or on the survival of dopaminergic neurons.
Applications:	dopaminergic agent A drug used for its effects on dopamine receptors, on the life cycle of dopamine, or on the survival of dopaminergic neurons. nootropic agent Any compound that improves mental functions such as cognition, memory, intelligence, motivation, attention, and concentration.

ChEBI Ontology

Outgoing Relation(s)
	7α-hydroxypregnenolone (CHEBI:81467) has functional parent pregnenolone (CHEBI:16581)
	7α-hydroxypregnenolone (CHEBI:81467) has role dopaminergic agent (CHEBI:48560)
	7α-hydroxypregnenolone (CHEBI:81467) has role marine metabolite (CHEBI:76507)
	7α-hydroxypregnenolone (CHEBI:81467) has role nootropic agent (CHEBI:66980)
	7α-hydroxypregnenolone (CHEBI:81467) has role rat metabolite (CHEBI:86264)
	7α-hydroxypregnenolone (CHEBI:81467) is a 20-oxo steroid (CHEBI:36885)
	7α-hydroxypregnenolone (CHEBI:81467) is a 3β-hydroxy-Δ⁵-steroid (CHEBI:1722)
	7α-hydroxypregnenolone (CHEBI:81467) is a 7α-hydroxy steroid (CHEBI:36843)
	7α-hydroxypregnenolone (CHEBI:81467) is a C₂₁-steroid (CHEBI:61313)

IUPAC Name
3β,7α-dihydroxypregn-5-en-20-one

Synonyms	Source
3beta,7alpha-Dihydroxy-5-pregnen-20-one	KEGG COMPOUND
(3β,7α)-3,7-dihydroxypregn-5-en-20-one	IUPAC

UniProt Name	Source
7α-hydroxypregnenolone	UniProt

Manual Xrefs	Databases
C18038	KEGG COMPOUND
HMDB0060424	HMDB

Registry Numbers	Sources
Reaxys:3157694	Reaxys

Citations