input word = C00047595

Metabolite InformationStructural formula
Name Tiegusanin K
Formula C36H38O10
Mw 630.24649744
CAS RN 1156503-62-6
C_ID C00047595 ,
InChIKey NBSWLXGUWZWWCH-JNJULKKLNA-N
InChICode InChI=1S/C36H38O10/c1-8-19(2)36(39)46-32-21(4)20(3)31(45-27(37)15-14-22-12-10-9-11-13-22)24-17-26-34(44-18-43-26)35(42-7)29(24)28-23(32)16-25(40-5)33(41-6)30(28)38/h8-17,20-21,31-32,38H,18H2,1-7H3/b15-14+,19-8+/t20-,21-,31+,32-/m0/s1
SMILES c12c([C@@H]([C@H]([C@@H]([C@@H](c3c1c(c(c(c3)OC)OC)O)OC(=O)/C(=C/C)/C)C)C)OC(=O)/C=C/c1ccccc1)cc1c(c2OC)OCO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeSchisandra propinqua var.sinensis Ref.
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