PCIDB

KNApSAcK Metabolite C00001241

Metabolite

KNApSAcK Entry

id C00001241
Name Vernolic acid
CAS RN 503-07-1
Standard InChI InChI=1S/C18H32O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h8,11,16-17H,2-7,9-10,12-15H2,1H3,(H,19,20)/b11-8-/t16-,17+/m1/s1
Standard InChI (Main Layer) InChI=1S/C18H32O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h8,11,16-17H,2-7,9-10,12-15H2,1H3,(H,19,20)

Cluster

Phytochemical cluster No. 70
KCF-S cluster No. 3504

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL281291

KEGG

By LinkDB C08368

CTD

By CAS RN C081136