CHEBI:69321 - 6beta-hydroxystigmast-4-en-3-one

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ChEBI Name 6beta-hydroxystigmast-4-en-3-one
ChEBI ID CHEBI:69321
Definition A natural product found in Beilschmiedia tsangii.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C29H48O2
Net Charge 0
Average Mass 428.69020
Monoisotopic Mass 428.36543
InChI InChI=1S/C29H48O2/c1-7-20(18(2)3)9-8-19(4)23-10-11-24-22-17-27(31)26-16-21(30)12-14-29(26,6)25(22)13-15-28(23,24)5/h16,18-20,22-25,27,31H,7-15,17H2,1-6H3/t19-,20-,22+,23-,24+,25+,27-,28-,29-/m1/s1
InChIKey IWNCBADONFSAAW-NFVQQQKOSA-N
SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])C[C@@H](O)C4=CC(=O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CC[C@@H](CC)C(C)C
Metabolite of Species Details
Beilschmiedia tsangii (IPNI:462970-1) Found in root (BTO:0001188). Cold MeOH extract of dry and sliced roots See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 6beta-hydroxystigmast-4-en-3-one (CHEBI:69321) has parent hydride stigmastane (CHEBI:26773)
6beta-hydroxystigmast-4-en-3-one (CHEBI:69321) has role metabolite (CHEBI:25212)
6beta-hydroxystigmast-4-en-3-one (CHEBI:69321) is a steroid (CHEBI:35341)
Citation Waiting for Citations Type Source
21846089 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:triterpenoid(CHEBI:36615); ISA:3-oxo Delta(4)-steroid(CHEBI:47909); ISA:6-hydroxy steroid(CHEBI:36849); ISA:steroid(CHEBI:35341); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:organic hydroxy compound(CHEBI:33822); ISA:secondary alcohol(CHEBI:35681); ISA:cyclic ketone(CHEBI:3992);