input word = C00047587

Metabolite InformationStructural formula
Name Tiegusanin C
Formula C30H34O8
Mw 522.22536806
CAS RN 1156503-54-6
C_ID C00047587 ,
InChIKey VQIUJKPVZMSRSS-UHFFFAOYNA-N
InChICode InChI=1S/C30H34O8/c1-16-13-19-14-21(33-3)26(35-5)28(37-7)23(19)24-20(25(31)17(16)2)15-22(34-4)27(36-6)29(24)38-30(32)18-11-9-8-10-12-18/h8-12,14-17,25,31H,13H2,1-7H3/t16-,17+,25-/m1/s1
SMILES c12c(C[C@H]([C@@H]([C@H](c3c1c(c(c(c3)OC)OC)OC(=O)c1ccccc1)O)C)C)cc(c(c2OC)OC)OC
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