input word = C00059924

Metabolite InformationStructural formula
Name 1-O-Decinnamoyl-1-O-benzoylohchinin
Formula C34H40O8
Mw 576.27231825
CAS RN 1429747-00-1
C_ID C00059924
InChIKey OUDPNSRFDKITGJ-OOEKXMBTSA-N
InChICode InChI=1S/C34H40O8/c1-18-21(20-11-12-39-16-20)13-22-27(18)34(4)23(14-26(36)38-5)33(3)25(42-31(37)19-9-7-6-8-10-19)15-24(35)32(2)17-40-28(29(32)33)30(34)41-22/h6-12,16,21-25,28-30,35H,13-15,17H2,1-5H3/t21-,22-,23-,24-,25+,28-,29+,30-,32-,33+,34-/m1/s1
SMILES COC(=O)CC1C2(C)C3=C(C)C(c4ccoc4)CC3OC2C2OCC3(C)C(O)CC(OC(=O)c4ccccc4)C1(C)C23
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeAzadirachta indica Ref.
zoom in