PCIDB

KNApSAcK Metabolite C00002777

Metabolite

KNApSAcK Entry

id C00002777
Name Sinapine / Sinapoylcholine
CAS RN 18696-26-9
Standard InChI InChI=1S/C16H23NO5/c1-17(2,3)8-9-22-15(18)7-6-12-10-13(20-4)16(19)14(11-12)21-5/h6-7,10-11H,8-9H2,1-5H3/p+1
Standard InChI (Main Layer) InChI=1S/C16H23NO5/c1-17(2,3)8-9-22-15(18)7-6-12-10-13(20-4)16(19)14(11-12)21-5/h6-7,10-11H,8-9H2,1-5H3

Cluster

Phytochemical cluster No. 6
KCF-S cluster No. 2905

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C00933

CTD

By CAS RN C005685