input word = C00008096

Metabolite InformationStructural formula
Name Kuwanon W
Formula C45H42O11
Mw 758.27271219
CAS RN 95518-95-9
C_ID C00008096 ,
InChIKey QAFIXEVKRZHTEV-LOVDHGJMNA-N
InChICode InChI=1S/C45H42O11/c1-21(2)6-9-29-42(54)39-35(51)20-34(50)38(44(39)55-43(29)26-11-8-24(47)19-33(26)49)31-17-22(3)16-30(25-10-7-23(46)18-32(25)48)37(31)41(53)28-12-13-36-27(40(28)52)14-15-45(4,5)56-36/h6-8,10-15,17-20,30-31,37,46-52H,9,16H2,1-5H3/t30-,31-,37-/m0/s1
SMILES C1=CC(Oc2c1c(c(cc2)C(=O)[C@@H]1[C@H](C=C(C[C@H]1c1ccc(cc1O)O)C)c1c(cc(c2c1oc(c(c2=O)CC=C(C)C)c1c(cc(cc1)O)O)O)O)O)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMoraceaeMorus lhou Ref.
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