input word = C00006440

Metabolite InformationStructural formula
Name GB1a-7''-O-glucoside
Formula C36H32O15
Mw 704.17412036
CAS RN 56663-56-0
C_ID C00006440 ,
InChIKey XDIGGNGQHOSYOL-SJRDWPPYNA-N
InChICode InChI=1S/C36H32O15/c37-13-25-30(44)32(46)33(47)36(51-25)50-24-12-21(43)26-20(42)11-22(14-1-5-16(38)6-2-14)48-35(26)28(24)29-31(45)27-19(41)9-18(40)10-23(27)49-34(29)15-3-7-17(39)8-4-15/h1-10,12,22,25,29-30,32-34,36-41,43-44,46-47H,11,13H2/t22-,25-,29-,30+,32-,33-,34+,36+/m0/s1
SMILES O=C1C[C@@H](c2ccc(O)cc2)Oc2c1c(O)cc(O[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1O)c2[C@H]1C(=O)c2c(O)cc(O)cc2O[C@@H]1c1ccc(O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeClusiaceae/Clusiaceae-GuttiferaeGarcinia multiflora Ref.
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