input word = C00064592

Metabolite InformationStructural formula
Name (+)-Viniferol E
Formula C56H44O13
Mw 924.27819149
CAS RN 870555-67-2
C_ID C00064592
InChIKey SLSQRFIWGCSNDI-ZBYKJNIJSA-N
InChICode InChI=1S/C56H44O13/c57-33-9-1-27(2-10-33)53-49(31-17-37(61)21-38(62)18-31)43-23-41(45(65)25-47(43)67-53)51-52(56(30-7-15-36(60)16-8-30)69-55(51)29-5-13-35(59)14-6-29)42-24-44-48(26-46(42)66)68-54(28-3-11-34(58)12-4-28)50(44)32-19-39(63)22-40(64)20-32/h1-26,49-66H/t49-,50-,51+,52+,53+,54+,55-,56+/m0/s1
SMILES Oc1ccc(C2Oc3cc(O)c(C4C(c5ccc(O)cc5)OC(c5ccc(O)cc5)C4c4cc5c(cc4O)OC(c4ccc(O)cc4)C5c4cc(O)cc(O)c4)cc3C2c2cc(O)cc(O)c2)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVitaceaeVitis amurensis Ref.
PlantaeVitaceaeVitis coignetiae Ref.
PlantaeVitaceaeVitis labrusca Ref.
PlantaeVitaceaeVitis vinifera Ref.
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