input word = C00005932

Metabolite InformationStructural formula
Name Kaempferide 3-rhamnoside-7-(6''-succinylglucoside)
Formula C32H36O18
Mw 708.19016435
CAS RN 107286-94-2
C_ID C00005932 ,
InChIKey USWCJNJGZZXFFW-CBLMKZBXNA-N
InChICode InChI=1S/C32H36O18/c1-12-22(37)25(40)27(42)31(46-12)50-30-24(39)21-16(33)9-15(10-17(21)48-29(30)13-3-5-14(44-2)6-4-13)47-32-28(43)26(41)23(38)18(49-32)11-45-20(36)8-7-19(34)35/h3-6,9-10,12,18,22-23,25-28,31-33,37-38,40-43H,7-8,11H2,1-2H3,(H,34,35)/t12-,18+,22-,23+,25+,26-,27-,28+,31-,32+/m0/s1
SMILES COc1ccc(-c2oc3cc(O[C@@H]4OC(COC(=O)CCC(=O)O)[C@@H](O)[C@H](O)C4O)cc(O)c3c(=O)c2O[C@@H]2OC(C)[C@H](O)C(O)[C@@H]2O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAspleniaceaeAsplenium bulbiferum Ref.
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