input word = C00043404

Metabolite InformationStructural formula
Name Cochinchiside B
Formula C27H28O12
Mw 544.15807636
CAS RN 690269-45-5
C_ID C00043404 ,
InChIKey KAXLSURJPZQJPA-ABTRRYMCNA-N
InChICode InChI=1S/C27H28O12/c28-13-18-20(31)21(32)23(38-24(33)15-7-2-1-3-8-15)25(37-18)39-22-16(9-6-10-17(22)29)14-36-26(34)27(35)12-5-4-11-19(27)30/h1-3,5-10,12,18,20-21,23,25,28-29,31-32,35H,4,11,13-14H2/t18-,20-,21+,23-,25+,27-/m1/s1
SMILES O=C(O[C@H]1[C@H](Oc2c(O)cccc2COC(=O)C2(O)C=CCCC2=O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFlacourtiaceaeHomalium cochinchinensis Ref.
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OrganismHomalium cochinchinensis
ReferenceIshikawa,J.Nat.Prod.,67,(2004),659