input word = C00007159

Metabolite InformationStructural formula
Name Xanthoangelol C
Formula C22H22O5
Mw 366.14672381
CAS RN 132998-82-4
C_ID C00007159 ,
InChIKey SXDGLCCGJJGJRY-FEUCYYSJSA-N
InChICode InChI=1S/C22H22O5/c1-15(3-2-14-23)4-10-18-21(26)13-11-19(22(18)27)20(25)12-7-16-5-8-17(24)9-6-16/h4-9,11-14,24,26-27H,2-3,10H2,1H3/b12-7+,15-4+
SMILES c1cc(ccc1/C=C/C(=O)c1ccc(c(c1O)C/C=C(\C)/CCC=O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica keiskei Ref.
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