input word = C00058574

Metabolite InformationStructural formula
Name Leachianol D
Formula C42H32O9
Mw 680.20463262
CAS RN 164204-61-9
C_ID C00058574
InChIKey OCYSKJMKPXUCTA-UHFFFAOYSA-N
InChICode InChI=1S/C42H32O9/c43-23-7-1-19(2-8-23)33-36-29(16-28(48)17-31(36)49)37-34(20-3-9-24(44)10-4-20)39-30(38(33)37)18-32-40(41(39)50)35(22-13-26(46)15-27(47)14-22)42(51-32)21-5-11-25(45)12-6-21/h1-18,33-35,37-38,42-50H
SMILES Oc1ccc(C2Oc3cc4c(c(O)c3C2c2cc(O)cc(O)c2)C(c2ccc(O)cc2)C2c3cc(O)cc(O)c3C(c3ccc(O)cc3)C42)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeSophora leachiana Ref.
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