input word = C00036312

Metabolite InformationStructural formula
Name (+)-Hopeaphenol
Formula C56H42O12
Mw 906.26762681
CAS RN 388582-37-4
C_ID C00036312 ,
InChIKey YQQUILZPDYJDQJ-IKPWFECENA-N
InChICode InChI=1S/C56H42O12/c57-29-9-1-25(2-10-29)45-47-37(17-33(61)21-41(47)65)53-49-39(19-35(63)23-43(49)67-55(53)27-5-13-31(59)14-6-27)51(45)52-40-20-36(64)24-44-50(40)54(56(68-44)28-7-15-32(60)16-8-28)38-18-34(62)22-42(66)48(38)46(52)26-3-11-30(58)12-4-26/h1-24,45-46,51-66H/t45-,46-,51+,52+,53-,54-,55+,56+/m0/s1
SMILES [C@H]12c3c([C@@H]([C@@H](c4c1c(cc(c4)O)O[C@@H]2c1ccc(cc1)O)[C@H]1[C@H](c2c([C@H]4c5c1cc(cc5O[C@@H]4c1ccc(cc1)O)O)cc(cc2O)O)c1ccc(cc1)O)c1ccc(cc1)O)c(cc(c3)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeVitaceaeVitis amurensis (Rupr.) Ref.
PlantaeVitaceaeVitis rotundifolia Ref.
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