input word = C00059264

Metabolite InformationStructural formula
Name beta-Hydroxypropiovanillone 3-glucoside
Formula C16H22O9
Mw 358.1263823
CAS RN 114226-07-2
C_ID C00059264
InChIKey YFXJLDCTEUBHCO-IBEHDNSVSA-N
InChICode InChI=1S/C16H22O9/c1-23-11-6-8(2-3-10(11)19)9(18)4-5-24-16-15(22)14(21)13(20)12(7-17)25-16/h2-3,6,12-17,19-22H,4-5,7H2,1H3/t12-,13-,14+,15-,16-/m1/s1
SMILES COc1cc(C(=O)CCOC2OC(CO)C(O)C(O)C2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePicea abies Ref.
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