CHEBI:92122 - Corynanthine

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ChEBI Name Corynanthine
ChEBI ID CHEBI:92122
Stars This entity has been manually annotated by a third party.
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Formulae C21H26N2O3
C21H26N2O3
Net Charge 0
Average Mass 354.444
Monoisotopic Mass 354.194
InChI InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19-/m0/s1
InChIKey BLGXFZZNTVWLAY-DKJBZYCGSA-N
SMILES COC(=O)[C@@H]1[C@H](CC[C@@H]2[C@@H]1C[C@H]3C4=C(CCN3C2)C5=CC=CC=C5N4)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 )
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ChEBI Ontology
Outgoing Corynanthine (CHEBI:92122) is a yohimban alkaloid (CHEBI:27358)
Synonym Source
(1S,15R,18S,19S,20S)-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylic acid methyl ester ChEBI
Manual Xref Database
LSM-2124 LINCS
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Last Modified
29 August 2018