input word = C00054585

Metabolite InformationStructural formula
Name Chavibetol glucoside
Formula C16H22O7
Mw 326.13655306
CAS RN 586398-38-1
C_ID C00054585
InChIKey LIEMWVYKRWIQMX-IBEHDNSVSA-N
InChICode InChI=1S/C16H22O7/c1-3-4-9-5-6-10(21-2)11(7-9)22-16-15(20)14(19)13(18)12(8-17)23-16/h3,5-7,12-20H,1,4,8H2,2H3/t12-,13-,14+,15-,16-/m1/s1
SMILES O[C@@H]1[C@@H](CO)O[C@@H](OC2=C(OC)C=CC(CC=C)=C2)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaePimpinella anisum Ref.
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