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.
zoom in



OrganismVitis rotundifolia
ReferenceSchrader, K. K. et al., Molecules, 23, (2018), 2761.