input word = C00039512

Metabolite InformationStructural formula
Name Kadangustin C
Formula C34H38O11
Mw 622.24141206
CAS RN 1013633-21-0
C_ID C00039512 ,
InChIKey HCRDYSMLGNXTDO-CCEZHUSRNA-N
InChICode InChI=1S/C34H38O11/c1-18-29(44-19(2)35)21-16-24(40-5)31(42-7)32(43-8)27(21)26-22(17-23(39-4)30(41-6)28(26)37)33(34(18,3)38)45-25(36)15-14-20-12-10-9-11-13-20/h9-18,29,33,37-38H,1-8H3/b15-14+/t18-,29+,33-,34+/m0/s1
SMILES c12c([C@@H]([C@@H]([C@@]([C@H](c3c1c(c(c(c3)OC)OC)O)OC(=O)/C=C\c1ccccc1)(C)O)C)OC(=O)C)cc(c(c2OC)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeKadsura angustifolia Ref.
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