PCIDB

KNApSAcK Metabolite C00022721

Metabolite

KNApSAcK Entry

id C00022721
Name Torulosic acid / Cupressic acid / 13R-Hydroxy-8(17),14-labdadien-19-oic acid
CAS RN 1909-90-6
Standard InChI InChI=1S/C20H32O3/c1-6-18(3,23)13-10-15-14(2)8-9-16-19(15,4)11-7-12-20(16,5)17(21)22/h6,15-16,23H,1-2,7-13H2,3-5H3,(H,21,22)/t15-,16?,18-,19+,20-/m0/s1
Standard InChI (Main Layer) InChI=1S/C20H32O3/c1-6-18(3,23)13-10-15-14(2)8-9-16-19(15,4)11-7-12-20(16,5)17(21)22/h6,15-16,23H,1-2,7-13H2,3-5H3,(H,21,22)

Cluster

Phytochemical cluster
KCF-S cluster No. 143

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL457163

KEGG

By LinkDB

CTD

By CAS RN