input word = C00057975

Metabolite InformationStructural formula
Name (-)-Viniferal
Viniferal
Formula C35H26O8
Mw 574.16276781
CAS RN 180413-42-7
C_ID C00057975
InChIKey DHTHKPNODOWMKF-VPIGGYNKSA-N
InChICode InChI=1S/C35H26O8/c36-17-18-1-10-29-27(11-18)32(35(42-29)20-4-8-23(38)9-5-20)28-15-26(41)16-30-33(28)31(21-12-24(39)14-25(40)13-21)34(43-30)19-2-6-22(37)7-3-19/h1-17,31-32,34-35,37-41H/t31-,32-,34+,35-/m0/s1
SMILES O=Cc1ccc2c(c1)[C@@H](c1cc(O)cc3c1[C@H](c1cc(O)cc(O)c1)[C@@H](c1ccc(O)cc1)O3)[C@H](c1ccc(O)cc1)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVitaceaeVitis amurensis Ref.
PlantaeVitaceaeVitis davidii Ref.
PlantaeVitaceaeVitis thunbergii Ref.
PlantaeVitaceaeVitis vinifera Ref.
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OrganismVitis vinifera
ReferenceIto, J. et al., Tetrahedron, 1996, 52, 9991-9998 (Viniferal)