input word = C00040675

Metabolite InformationStructural formula
Name Xanthokeismin A
Formula C25H28O5
Mw 408.193674
CAS RN 1037256-65-7
C_ID C00040675 ,
InChIKey QJCKCZSARZRFFO-OILXWVNISA-N
InChICode InChI=1S/C25H28O5/c1-17(5-4-16-25(2,3)30)6-12-20-23(28)15-13-21(24(20)29)22(27)14-9-18-7-10-19(26)11-8-18/h4,6-11,13-16,26,28-30H,5,12H2,1-3H3/b14-9+,16-4+,17-6+
SMILES c1(ccc(cc1)O)/C=C/C(=O)c1c(c(c(cc1)O)C/C=C(/C/C=C/C(C)(O)C)\C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica keiskei Ref.
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