CHEBI:16791 - vinorine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name vinorine
ChEBI ID CHEBI:16791
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:9989, CHEBI:15310
Supplier Information
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Formula C21H22N2O2
Net Charge 0
Average Mass 334.41166
Monoisotopic Mass 334.16813
InChI InChI=1S/C21H22N2O2/c1-3-12-10-23-16-8-13(12)18-17(23)9-21(20(18)25-11(2)24)14-6-4-5-7-15(14)22-19(16)21/h3-7,13,16-18,20H,8-10H2,1-2H3/b12-3-/t13-,16-,17-,18?,20+,21+/m0/s1
InChIKey CLDVMRAEPFQOSD-WEOXKLFPSA-N
SMILES [H][C@]12C[C@]3([H])N(C\C1=C\C)[C@H]1C[C@@]4([C@H](OC(C)=O)C21)c1ccccc1N=C34
ChEBI Ontology
Outgoing vinorine (CHEBI:16791) has functional parent ajmaline (CHEBI:28462)
vinorine (CHEBI:16791) is a acetate ester (CHEBI:47622)
Incoming vomilenine (CHEBI:16408) has functional parent vinorine (CHEBI:16791)
IUPAC Name
22-norajmala-1,19-dien-17α-yl acetate
Synonyms Sources
Vinorine KEGG COMPOUND
vinorine UniProt
Manual Xref Database
C11807 KEGG COMPOUND
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Last Modified
05 August 2015