PCIDB

KNApSAcK Metabolite C00025720

Metabolite

KNApSAcK Entry

id C00025720
Name Epiisositsirikine / 16-Epiisositsirikine / 16-epi-Isositsirikine / 16-epi-19E-Isositsirikine
CAS RN 60031-91-6
Standard InChI InChI=1S/C21H26N2O3/c1-3-13-11-23-9-8-15-14-6-4-5-7-18(14)22-20(15)19(23)10-16(13)17(12-24)21(25)26-2/h3-7,16-17,19,22,24H,8-12H2,1-2H3/b13-3-/t16-,17+,19-/m0/s1
Standard InChI (Main Layer) InChI=1S/C21H26N2O3/c1-3-13-11-23-9-8-15-14-6-4-5-7-18(14)22-20(15)19(23)10-16(13)17(12-24)21(25)26-2/h3-7,16-17,19,22,24H,8-12H2,1-2H3

Cluster

Phytochemical cluster No. 4
KCF-S cluster No. 260

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL453018

KEGG

By LinkDB

CTD

By CAS RN