input word = C00047593

Metabolite InformationStructural formula
Name Tiegusanin I
Formula C31H38O10
Mw 570.24649744
CAS RN 1156503-60-4
C_ID C00047593 ,
InChIKey BTKZCBGTFRTOHM-XNTDXEJSNA-N
InChICode InChI=1S/C31H38O10/c1-10-15(3)31(33)41-26-17(5)16(4)25(40-22(32)11-2)19-13-21-28(39-14-38-21)30(37-9)24(19)23-18(26)12-20(34-6)27(35-7)29(23)36-8/h10,12-13,16-17,25-26H,11,14H2,1-9H3/b15-10+/t16-,17-,25-,26-/m0/s1
SMILES c12c([C@H]([C@H]([C@@H]([C@@H](c3c1c(c(c(c3)OC)OC)OC)OC(=O)/C(=C/C)/C)C)C)OC(=O)CC)cc1c(c2OC)OCO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeSchisandra propinqua var.sinensis Ref.
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OrganismSchisandra propinqua var.sinensis
ReferenceLi,J.Nat.Prod.,72,(2009),1133