CHEBI:67715 - N-methylgitingensine

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ChEBI Name N-methylgitingensine
ChEBI ID CHEBI:67715
Definition A natural product found in Kibatalia laurifolia.
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H33NO2
Net Charge 0
Average Mass 343.50290
Monoisotopic Mass 343.25113
InChI InChI=1S/C22H33NO2/c1-13-17-6-7-19-16-5-4-14-12-15(23-3)8-10-21(14,2)18(16)9-11-22(17,19)20(24)25-13/h4,13,15-19,23H,5-12H2,1-3H3/t13-,15+,16+,17+,18-,19-,21-,22-/m0/s1
InChIKey RSFPISDAJMWREU-UACFYWDWSA-N
SMILES [H][C@]12CC[C@@]3([H])[C@]4([H])CC=C5C[C@@H](CC[C@]5(C)[C@@]4([H])CC[C@]13C(=O)O[C@H]2C)NC
Metabolite of Species Details
Kibatalia laurifolia (IPNI:79456-1) Found in leaf (BTO:0000713). Dried, ground leaves were alkalized with NH4OH & extracted successively with n-hexane, CH2Cl2 & MeOH 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 N-methylgitingensine (CHEBI:67715) has role metabolite (CHEBI:25212)
N-methylgitingensine (CHEBI:67715) is a steroid (CHEBI:35341)
Synonym Source
(3alpha,20S)-3-(Methylamino)-18,20-epoxypregn-5-en-18-one ChEBI
Citation Waiting for Citations Type Source
21443172 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:terpene lactone(CHEBI:37668); ISA:sesquiterpenoid(CHEBI:26658); ISA:primary aliphatic amine(CHEBI:17062); ISA:gamma-lactone(CHEBI:37581); ISA:oxolanes(CHEBI:26912); ISA:carboxylic ester(CHEBI:33308); ISA:ether(CHEBI:25698); ISA:secondary amino compound(CHEBI:50995); ISA:carbonyl compound(CHEBI:36586);