PCIDB

KNApSAcK Metabolite C00011215

Metabolite

KNApSAcK Entry

id C00011215
Name Setoclavine
CAS RN 519-12-0
Standard InChI InChI=1S/C16H18N2O/c1-16(19)7-12-11-4-3-5-13-15(11)10(8-17-13)6-14(12)18(2)9-16/h3-5,7-8,14,17,19H,6,9H2,1-2H3/t14-,16+/m1/s1
Standard InChI (Main Layer) InChI=1S/C16H18N2O/c1-16(19)7-12-11-4-3-5-13-15(11)10(8-17-13)6-14(12)18(2)9-16/h3-5,7-8,14,17,19H,6,9H2,1-2H3

Cluster

Phytochemical cluster No. 4
KCF-S cluster No. 657

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN