PCIDB

KNApSAcK Metabolite C00028701

Metabolite

KNApSAcK Entry

id C00028701
Name N-Methylhernovine / (-)-N-Methylhernovine
CAS RN 5550-65-2
Standard InChI InChI=1S/C19H21NO4/c1-20-7-6-11-9-14(22)19(24-3)17-15(11)12(20)8-10-4-5-13(21)18(23-2)16(10)17/h4-5,9,12,21-22H,6-8H2,1-3H3/t12-/m0/s1
Standard InChI (Main Layer) InChI=1S/C19H21NO4/c1-20-7-6-11-9-14(22)19(24-3)17-15(11)12(20)8-10-4-5-13(21)18(23-2)16(10)17/h4-5,9,12,21-22H,6-8H2,1-3H3

Cluster

Phytochemical cluster No. 4
KCF-S cluster No. 20

Link

ChEMBL

By standard InChI CHEMBL1183924
By standard InChI Main Layer CHEMBL1183924

KEGG

By LinkDB

CTD

By CAS RN