input word = C00008925

Metabolite InformationStructural formula
Name Mesquitol-(5->6)-mesquitol
Formula C30H26O12
Mw 578.1424263
CAS RN 89613-25-2
C_ID C00008925 ,
InChIKey RWRTUINVQGEZBY-GAPUQXMCNA-N
InChICode InChI=1S/C30H26O12/c31-17-3-1-11(6-19(17)33)27-22(36)8-13-5-15(24(38)26(40)29(13)41-27)14-9-21(35)25(39)30-16(14)10-23(37)28(42-30)12-2-4-18(32)20(34)7-12/h1-7,9,22-23,27-28,31-40H,8,10H2/t22-,23-,27+,28-/m0/s1
SMILES Oc1ccc([C@H]2Oc3c(cc(-c4cc(O)c(O)c5c4C[C@H](O)[C@@H](c4ccc(O)c(O)c4)O5)c(O)c3O)C[C@@H]2O)cc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeProsopis glandulosa Ref.
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