input word = C00006153

Metabolite InformationStructural formula
Name Isovolubilin
Formula C23H24O9
Mw 444.14203237
CAS RN 56317-19-2
C_ID C00006153 ,
InChIKey MUVXOBQROCNFJU-FELISDOFNA-N
InChICode InChI=1S/C23H24O9/c1-10-18(24)21(27)22(28)23(32-10)17-14(30-3)8-15-16(20(17)26)19(25)13(9-31-15)11-4-6-12(29-2)7-5-11/h4-10,18,21-24,26-28H,1-3H3/t10-,18-,21-,22+,23-/m0/s1
SMILES c1(c(c(c2c(c1)occ(c2=O)c1ccc(cc1)OC)O)[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDalbergia volubilis Ref.
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