input word = C00041963

Metabolite InformationStructural formula
Name Xanthoangelol I
(+)-Xanthoangelol I
Formula C25H28O4
Mw 392.19875938
CAS RN 878277-37-3
C_ID C00041963 ,
InChIKey AJTWDECGQXIMQX-XYOKQWHBNA-N
InChICode InChI=1S/C25H28O4/c1-17(2)5-4-15-25(3)16-14-21-23(28)13-11-20(24(21)29-25)22(27)12-8-18-6-9-19(26)10-7-18/h5-13,26,28H,4,14-16H2,1-3H3/b12-8+/t25-/m0/s1
SMILES c1cc(c2c(c1C(=O)/C=C/c1ccc(cc1)O)O[C@](CC2)(CCC=C(C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica keiskei Ref.
zoom in