CHEBI:797 - 19-Hydroxytabersonine

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ChEBI Name 19-Hydroxytabersonine
ChEBI ID CHEBI:797
Stars This entity has been manually annotated by a third party.
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Formula C21H24N2O3
Net Charge 0
Average Mass 352.428
Monoisotopic Mass 352.17869
InChI InChI=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
InChIKey XDGRXQNYJMQLPU-VFZBCNBRSA-N
SMILES COC(=O)C1=C2Nc3ccccc3[C@@]22CCN3CC=C[C@](C1)(C(C)O)[C@@H]23
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 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 (−)-(R)-19-hydroxytabersonine(1+) (CHEBI:144372) is conjugate acid of 19-Hydroxytabersonine (CHEBI:797)
Synonym Source
19-Hydroxytabersonine KEGG COMPOUND
Manual Xrefs Databases
C00024501 KNApSAcK
C11642 KEGG COMPOUND
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Last Modified
09 March 2018