input word = C00009034

Metabolite InformationStructural formula
Name 3,5,7,4'-Tetrahydroxyflavan-(4-O-4)-3,5,7,4'-tetrahydroxyflavan
Formula C30H26O11
Mw 562.14751167
CAS RN 16280-14-1
C_ID C00009034 ,
InChIKey XGAAZLWGTKBYNG-UHFFFAOYNA-N
InChICode InChI=1S/C30H26O11/c31-15-5-1-13(2-6-15)27-25(37)29(23-19(35)9-17(33)11-21(23)39-27)41-30-24-20(36)10-18(34)12-22(24)40-28(26(30)38)14-3-7-16(32)8-4-14/h1-12,25-38H/t25-,26+,27-,28+,29-,30-/m1/s1
SMILES c1(cc(c2c(c1)O[C@H]([C@@H]([C@@H]2O[C@H]1[C@@H]([C@H](Oc2c1c(cc(c2)O)O)c1ccc(cc1)O)O)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeSalacia chinensis Ref.
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