input word = C00040716

Metabolite InformationStructural formula
Name Xylocarpin H
(+)-Xylocarpin H
Formula C32H38O10
Mw 582.24649744
CAS RN 939775-80-1
C_ID C00040716 ,
InChIKey ZBJPDPDKXYNWFV-CWZKILDYNA-N
InChICode InChI=1S/C32H38O10/c1-8-17(2)29(37)42-28(20-15-30(4,5)21(13-24(34)39-7)18(3)26(20)36)32(38)22-14-25(35)41-27(19-10-12-40-16-19)31(22,6)11-9-23(32)33/h8,10,12,14-16,18,21,27-28,38H,9,11,13H2,1-7H3/b17-8+/t18-,21+,27+,28-,31-,32+/m1/s1
SMILES [C@@]1(C2=CC(=O)O[C@H]([C@@]2(CCC1=O)C)c1ccoc1)([C@@H](C1=CC([C@H]([C@H](C1=O)C)CC(=O)OC)(C)C)OC(=O)/C(=C/C)/C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeXylocarpus granatum Ref.
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OrganismXylocarpus granatum
ReferenceCui,J.Nat.Prod.,70,(2007),772