input word = C00029489

Metabolite InformationStructural formula
Name 3-Butylidenephthalide
Formula C12H12O2
Mw 188.08372963
CAS RN 551-08-6
C_ID C00029489 ,
InChIKey WMBOCUXXNSOQHM-FLIBITNWSA-N
InChICode InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8-
SMILES c1ccc2c(c1)C(=O)O/C/2=C\CCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeLigusticum chuanxiong HORT. Ref.
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