input word = C00022425

Metabolite InformationStructural formula
Name Salvic acid
Formula C20H34O3
Mw 322.25079495
CAS RN 70574-04-8
C_ID C00022425 ,
InChIKey UFGJFRRXTBBPQS-TUFKGFNTNA-N
InChICode InChI=1S/C20H34O3/c1-13(11-18(22)23)7-8-15-14(2)16(21)12-17-19(3,4)9-6-10-20(15,17)5/h13,15-17,21H,2,6-12H2,1,3-5H3,(H,22,23)/t13-,15-,16+,17-,20-/m1/s1
SMILES C=C1[C@@H](CC[C@@H](C)CC(=O)O)[C@]2(C)CCCC(C)(C)[C@H]2C[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium salvia Ref.
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