PCIDB

KNApSAcK Metabolite C00025082

Metabolite

KNApSAcK Entry

id C00025082
Name Schizophylline
CAS RN 2447-60-1
Standard InChI InChI=1S/C21H26N2O3/c1-25-14-4-5-15-16-6-11-23-10-3-7-20(13-18(24)26-2)8-9-21(16,19(20)23)22-17(15)12-14/h3-5,7,12,16,19,22H,6,8-11,13H2,1-2H3/t16-,19+,20+,21-/m1/s1
Standard InChI (Main Layer) InChI=1S/C21H26N2O3/c1-25-14-4-5-15-16-6-11-23-10-3-7-20(13-18(24)26-2)8-9-21(16,19(20)23)22-17(15)12-14/h3-5,7,12,16,19,22H,6,8-11,13H2,1-2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 6146

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN