input word = C00021727

Metabolite InformationStructural formula
Name alpha-Perezol
Formula C20H26O5
Mw 346.17802394
CAS RN 38044-08-5
C_ID C00021727 ,
InChIKey CNSCLIJSQQBULZ-OUWMJXPVNA-N
InChICode InChI=1S/C20H26O5/c1-7-10(2)16(23)25-20-12(4)14(21)15(22)19(17(20)24)11(3)8-9-13(19)18(20,5)6/h7,11,13,21H,8-9H2,1-6H3/b10-7+/t11-,13+,19+,20+/m1/s1
SMILES C1C[C@H]([C@@]23[C@@H]1C([C@@](C2=O)(C(=C(C3=O)O)C)OC(=O)/C(=C/C)/C)(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePerezia hebeclada Ref.
zoom in