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rauvomitine

Go to external page http://purl.obolibrary.org/obo/CHEBI_142029

A monoterpenoid indole alkaloid with formula C30H34N2O5.

Term info

Label

rauvomitine

Synonyms
  • (16xi,17R,19E)-ajmal-19-en-17-yl 3,4,5-trimethoxybenzoate
database cross reference
Subsets

3_STAR

IUPAC NAME
(16xi,17R,19E)-ajmal-19-en-17-yl 3,4,5-trimethoxybenzoate [ IUPAC ]

charge

0

formula

C30H34N2O5

has obo namespace

chebi_ontology

has related synonym

(-)-rauvomitine, rauvomitin

id

CHEBI:142029

inchi

InChI=1S/C30H34N2O5/c1-6-16-15-32-21-13-18(16)25-22(32)14-30(19-9-7-8-10-20(19)31(2)27(21)30)28(25)37-29(33)17-11-23(34-3)26(36-5)24(12-17)35-4/h6-12,18,21-22,25,27-28H,13-15H2,1-5H3/b16-6-/t18-,21-,22-,25-,27-,28+,30+/m0/s1

inchikey

JHWXXJLDNKFDNH-OGWDYSPGSA-N

mass

502.602

monoisotopicmass

502.24677

smiles

[H][C@@]12[C@@H]3C[C@@]4([C@@](N(C5=CC=CC=C54)C)([C@@]6(C[C@H]1/C(/CN36)=C\C)[H])[H])[C@@H]2OC(C=7C=C(C(=C(C7)OC)OC)OC)=O