CHEBI:141959 - Trimethoxy-3,4,5-cinnamate-vincamajine

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Trimethoxy-3,4,5-cinnamate-vincamajine
ChEBI ID CHEBI:141959
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
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Formula C34H38N2O7
Net Charge 0
Average Mass 586.676
Monoisotopic Mass 586.26790
InChI InChI=1S/C34H38N2O7/c1-7-20-18-36-24-16-22(20)34(32(38)42-6)27(36)17-33(21-10-8-9-11-23(21)35(2)30(24)33)31(34)43-28(37)13-12-19-14-25(39-3)29(41-5)26(15-19)40-4/h7-15,22,24,27,30-31H,16-18H2,1-6H3/b13-12+,20-7-/t22-,24-,27-,30+,31-,33?,34?/m0/s1
InChIKey MMWULTFKKMQANL-HERIOXFGSA-N
SMILES C/C=C\1/CN2[C@]3(C[C@@]1(C4([C@@]2(CC5(C6=CC=CC=C6N(C)[C@]35[H])[C@@]4(OC(\C=C\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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Trimethoxy-3,4,5-cinnamate-vincamajine (CHEBI:141959) is a monoterpenoid indole alkaloid (CHEBI:65323)
Last Modified
19 December 2018