input word = C00041229

Metabolite InformationStructural formula
Name (9Z,11S,16R)-Dihydroxyoctadeca-9,17-dien-12,14-diyn-1-yl acetate
Formula C20H28O4
Mw 332.19875938
CAS RN 213905-35-2
C_ID C00041229 ,
InChIKey VVURZXYIXNNJCG-DLMQGEPANA-N
InChICode InChI=1S/C20H28O4/c1-3-19(22)14-11-12-16-20(23)15-10-8-6-4-5-7-9-13-17-24-18(2)21/h3,10,15,19-20,22-23H,1,4-9,13,17H2,2H3/b15-10-/t19-,20+/m1/s1
SMILES C=C[C@@H](O)C#CC#C[C@@H](O)/C=CCCCCCCCCOC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica keiskei Ref.
PlantaeApiaceaeAngelica sinensis Ref.
zoom in