PCIDB

KNApSAcK Metabolite C00002478

Metabolite

KNApSAcK Entry

id C00002478
Name Isosamidin
CAS RN 53023-18-0
Standard InChI InChI=1S/C21H22O7/c1-11(2)10-16(24)27-19-17-14(28-21(4,5)20(19)25-12(3)22)8-6-13-7-9-15(23)26-18(13)17/h6-10,19-20H,1-5H3/t19-,20-/m1/s1
Standard InChI (Main Layer) InChI=1S/C21H22O7/c1-11(2)10-16(24)27-19-17-14(28-21(4,5)20(19)25-12(3)22)8-6-13-7-9-15(23)26-18(13)17/h6-10,19-20H,1-5H3

Cluster

Phytochemical cluster No. 25
KCF-S cluster No. 224

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C09270

CTD

By CAS RN