CHEBI:142668 - intermediate I

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ChEBI Name intermediate I
ChEBI ID CHEBI:142668
Definition A four-electron reduction will result in CHEBI:9260
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C21H23N2O3
Net Charge +1
Average Mass 351.420
Monoisotopic Mass 351.17032
InChI InChI=1S/C21H23N2O3/c1-3-14-12-23-10-8-16-15-6-4-5-7-18(15)22-19(16)21(13-24,20(25)26-2)17(14)9-11-23/h3-7,11,13,17,22H,8-10,12H2,1-2H3/q+1/b14-3-/t17-,21-/m0/s1
InChIKey QWXYZCJEXYQNEI-OSZHWHEXSA-N
SMILES C12=C(C=CC=C1)NC=3[C@]([C@@]4(/C(/C[N+](=CC4)CCC32)=C\C)[H])(C(=O)OC)C=O
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 intermediate I (CHEBI:142668) is a monoterpenoid indole alkaloid (CHEBI:65323)
intermediate I (CHEBI:142668) is a organic cation (CHEBI:25697)
intermediate I (CHEBI:142668) is a organic heterotetracyclic compound (CHEBI:38163)
Synonym Source
3,17-didehydrostemmadenine UniProt
Citation Waiting for Citations Type Source
29511102 PubMed citation SUBMITTER
Last Modified
16 April 2024