input word = C00041921

Metabolite InformationStructural formula
Name Tigloylgomisin P
Formula C28H34O9
Mw 514.22028269
CAS RN 69176-51-8
C_ID C00041921 ,
InChIKey BKGUPIVDQHHVMV-NTEUORMPNA-N
InChICode InChI=1S/C28H34O9/c1-9-14(2)27(29)37-26-17-12-18(31-5)22(32-6)25(34-8)21(17)20-16(10-15(3)28(26,4)30)11-19-23(24(20)33-7)36-13-35-19/h9,11-12,15,26,30H,10,13H2,1-8H3/b14-9+/t15-,26+,28+/m0/s1
SMILES c12c(C[C@@H]([C@@]([C@@H](c3c1c(c(c(c3)OC)OC)OC)OC(=O)/C(=C/C)/C)(C)O)C)cc1c(c2OC)OCO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSchisandraceaeSchisandra chinensis Ref.
PlantaeSchisandraceaeSchisandra rubriflora Ref.
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OrganismSchisandra rubriflora
ReferenceChen,J.Nat.Prod.,69,(2006),1697