input word = C00063236

Metabolite InformationStructural formula
Name 8-beta-D-Glucopyranosyloxy-2,7-dimethyl-2,4-decadiene-1,10-dioic acid
Formula C18H28O10
Mw 404.16824712
CAS RN 870456-23-8
C_ID C00063236
InChIKey WHRWRZSKZMYJOX-GCIJFTNRSA-N
InChICode InChI=1S/C18H28O10/c1-9(5-3-4-6-10(2)17(25)26)11(7-13(20)21)27-18-16(24)15(23)14(22)12(8-19)28-18/h3-4,6,9,11-12,14-16,18-19,22-24H,5,7-8H2,1-2H3,(H,20,21)(H,25,26)/b4-3+,10-6+/t9?,11?,12-,14-,15+,16-,18-/m1/s1
SMILES CC(=CC=CCC(C)C(CC(=O)O)OC1OC(CO)C(O)C(O)C1O)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeVicia faba Ref.
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