PCIDB

KNApSAcK Metabolite C00025903

Metabolite

KNApSAcK Entry

id C00025903
Name Isobonafousine
CAS RN 76202-19-2
Standard InChI InChI=1S/C35H40N4O3/c1-3-20-15-19-17-35(34(41)42-2)32-23(12-14-38(18-19)33(20)35)22-10-11-28(40)29(30(22)37-32)26-16-24-21-7-4-5-9-27(21)39-13-6-8-25(36-26)31(24)39/h4-5,7,9-11,19-20,25-26,33,36-37,40H,3,6,8,12-18H2,1-2H3
Standard InChI (Main Layer) InChI=1S/C35H40N4O3/c1-3-20-15-19-17-35(34(41)42-2)32-23(12-14-38(18-19)33(20)35)22-10-11-28(40)29(30(22)37-32)26-16-24-21-7-4-5-9-27(21)39-13-6-8-25(36-26)31(24)39/h4-5,7,9-11,19-20,25-26,33,36-37,40H,3,6,8,12-18H2,1-2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 4902

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN