input word = C00008212

Metabolite InformationStructural formula
Name Prunin 3''-p-coumarate
Formula C30H28O12
Mw 580.15807636
CAS RN 84813-73-0
C_ID C00008212 ,
InChIKey BEHIONSZUBFJLA-LSFOAPLINA-N
InChICode InChI=1S/C30H28O12/c31-14-24-27(37)29(42-25(36)10-3-15-1-6-17(32)7-2-15)28(38)30(41-24)39-19-11-20(34)26-21(35)13-22(40-23(26)12-19)16-4-8-18(33)9-5-16/h1-12,22,24,27-34,37-38H,13-14H2/b10-3+/t22-,24-,27+,28+,29-,30+/m0/s1
SMILES c1(cc(c2c(c1)O[C@@H](CC2=O)c1ccc(cc1)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)OC(=O)/C=C/c1ccc(cc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeMabea caudata Ref.
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