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CHEBI:797 - 19-Hydroxytabersonine

ChEBI IDCHEBI:797
ChEBI Name19-Hydroxytabersonine
Stars
Last Modified9 March 2018
DownloadsMolfile
FormulaC21H24N2O3
Net Charge0
Average Mass352.434
Monoisotopic Mass352.17869
SMILES[H][C@]12N3CC=C[C@@]1(C(C)O)CC(C(=O)OC)=C1Nc4ccccc4[C@@]12CC3
InChIInChI=1S/C21H24N2O3/c1-13(24)20-8-5-10-23-11-9-21(19(20)23)15-6-3-4-7-16(15)22-17(21)14(12-20)18(25)26-2/h3-8,13,19,22,24H,9-12H2,1-2H3/t13?,19-,20-,21-/m0/s1
InChIKeyXDGRXQNYJMQLPU-VFZBCNBRSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
19-Hydroxytabersonine (CHEBI:797) is a alkaloid (CHEBI:22315)
19-Hydroxytabersonine (CHEBI:797) is a methyl ester (CHEBI:25248)
19-Hydroxytabersonine (CHEBI:797) is conjugate base of (−)-(R)-19-hydroxytabersonine(1+) (CHEBI:144372)
Incoming Relation(s)
(−)-(R)-19-hydroxytabersonine(1+) (CHEBI:144372) is conjugate acid of 19-Hydroxytabersonine (CHEBI:797)
Synonym  Source
19-HydroxytabersonineKEGG COMPOUND
Manual XrefsDatabases
C11642KEGG COMPOUND
C00024501KNApSAcK