CHEBI:141932 - O-trimethoxy-3,4,5-benzoyl-OH-vincamajine

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ChEBI Name O-trimethoxy-3,4,5-benzoyl-OH-vincamajine
ChEBI ID CHEBI:141932
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
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Formula C32H36N2O8
Net Charge 0
Average Mass 576.638
Monoisotopic Mass 576.24717
InChI InChI=1S/C32H36N2O8/c1-7-16-15-34-22-13-19(16)32(30(37)41-6)25(34)14-31(20-12-18(35)8-9-21(20)33(2)27(22)31)29(32)42-28(36)17-10-23(38-3)26(40-5)24(11-17)39-4/h7-12,19,22,25,27,29,35H,13-15H2,1-6H3/b16-7-/t19-,22-,25-,27+,29-,31?,32?/m0/s1
InChIKey QZYBQHBBKYUFTE-JBLJBMSWSA-N
SMILES C/C=C\1/CN2[C@]3(C[C@@]1(C4([C@@]2(CC5(C=6C=C(C=CC6N(C)[C@]35[H])O)[C@@]4(OC(C7=CC(=C(C(=C7)OC)OC)OC)=O)[H])[H])C(=O)OC)[H])[H]
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 O-trimethoxy-3,4,5-benzoyl-OH-vincamajine (CHEBI:141932) is a monoterpenoid indole alkaloid (CHEBI:65323)
Last Modified
30 August 2018