input word = C00059327

Metabolite InformationStructural formula
Name (4beta,15alpha)-15-Hydroxy-trachyloban-18-oic acid
Formula C20H30O3
Mw 318.21949482
CAS RN 117249-13-5
C_ID C00059327
InChIKey MHVNHDYWKUKRRJ-MGLRGOIASA-N
InChICode InChI=1S/C20H30O3/c1-17-6-4-7-18(2,16(22)23)13(17)5-8-20-10-12-11(9-14(17)20)19(12,3)15(20)21/h11-15,21H,4-10H2,1-3H3,(H,22,23)/t11?,12-,13-,14-,15-,17+,18-,19+,20+/m0/s1
SMILES CC1(C(=O)O)CCCC2(C)C1CCC13CC4C(CC21)C4(C)C3O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelianthus annuus Ref.
zoom in