CHEBI:70413 - 1',2'-didehydrostemofoline

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ChEBI Name 1',2'-didehydrostemofoline
ChEBI ID CHEBI:70413
Definition A natural product found in Stemona curtisii.
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C22H27NO5
Net Charge 0
Average Mass 385.45350
Monoisotopic Mass 385.18892
InChI InChI=1S/C22H27NO5/c1-5-6-8-21-14-7-9-23(21)13-10-15(21)27-22(14)16(13)11(2)18(28-22)19-17(25-4)12(3)20(24)26-19/h6,8,11,13-16H,5,7,9-10H2,1-4H3/b8-6+,19-18-/t11-,13-,14+,15-,16+,21-,22+/m0/s1
InChIKey XNUWGEPKIOWLHQ-KQYNXQAPSA-N
SMILES [H][C@]12C[C@]3([H])N4CC[C@@]([H])([C@]5(O\C([C@@H](C)[C@]35[H])=C3OC(=O)C(C)=C/3OC)O1)[C@@]24\C=C\CC
Metabolite of Species Details
Stemona curtisii (NCBI:txid492018) Found in root (BTO:0001188). 95% EtOH extract of dry, ground 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.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1',2'-didehydrostemofoline (CHEBI:70413) has role metabolite (CHEBI:25212)
1',2'-didehydrostemofoline (CHEBI:70413) is a alkaloid (CHEBI:22315)
Citation Waiting for Citations Type Source
21049906 PubMed citation Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:organic heterotricyclic compound(CHEBI:26979); ISA:alkaloid(CHEBI:22315); ISA:tropane alkaloid(CHEBI:37332); ISA:furopyran(CHEBI:74927); ISA:pyrrolizines(CHEBI:38522); ISA:azepanes(CHEBI:46986); ISA:piperidines(CHEBI:26151); ISA:pyrans(CHEBI:26407); ISA:butenolide(CHEBI:50523); ISA:oxanes(CHEBI:46942); ISA:N-alkylpyrrolidine(CHEBI:46775); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enoate ester(CHEBI:51702); ISA:oxolanes(CHEBI:26912); ISA:furans(CHEBI:24129); ISA:ester(CHEBI:35701); ISA:lactone(CHEBI:25000); ISA:tertiary amine(CHEBI:32876); ISA:acetal(CHEBI:59769); ISA:monocarboxylic acid(CHEBI:25384); ISA:carbonyl compound(CHEBI:36586);