input word = C00047596

Metabolite InformationStructural formula
Name Tiegusanin L
Formula C31H32O8
Mw 532.209718
CAS RN 1156503-63-7
C_ID C00047596 ,
InChIKey ZUSDJUTXFWPDCB-VAWYXSNFNA-N
InChICode InChI=1S/C31H32O8/c1-17-13-20-14-23-29(38-16-37-23)30(35-4)25(20)26-21(15-22(32)28(34-3)31(26)36-5)27(18(17)2)39-24(33)12-11-19-9-7-6-8-10-19/h6-12,14-15,17-18,27,32H,13,16H2,1-5H3/b12-11+/t17-,18+,27-/m1/s1
SMILES c12c(C[C@H]([C@@H]([C@H](c3c1c(c(c(c3)O)OC)OC)OC(=O)/C=C/c1ccccc1)C)C)cc1c(c2OC)OCO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeSchisandra propinqua var.sinensis Ref.
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