input word = C00036719

Metabolite InformationStructural formula
Name Amurensin K
(+)-Amurensin K
Formula C56H40O13
Mw 920.24689137
CAS RN 388121-56-0
C_ID C00036719 ,
InChIKey KYCWATKXJOSHQR-OUZCEPSNNA-N
InChICode InChI=1S/C56H40O13/c57-30-8-1-25(2-9-30)47-49(38-20-36(63)22-45-51(38)53(39-19-35(62)21-42(65)50(39)47)55(68-45)27-5-12-32(59)13-6-27)37-17-28(7-14-41(37)64)44-23-40-52-46(24-43(66)56(40)67-44)69-54(26-3-10-31(58)11-4-26)48(52)29-15-33(60)18-34(61)16-29/h1-24,47-49,53-55,57-66H/t47-,48+,49+,53+,54-,55-/m1/s1
SMILES Oc1ccc([C@H]2c3c(O)cc(O)cc3[C@H]3c4c(cc(O)cc4[C@@H]2c2cc(-c4cc5c6c(cc(O)c5o4)O[C@H](c4ccc(O)cc4)[C@H]6c4cc(O)cc(O)c4)ccc2O)O[C@@H]3c2ccc(O)cc2)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVitaceaeVitis amurensis (Rupr.) Ref.
PlantaeVitaceaeVitis davidii Ref.
PlantaeVitaceaeVitis thunbergii Ref.
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