PCIDB

KNApSAcK Metabolite C00038318

Metabolite

KNApSAcK Entry

id C00038318
Name 7-Epiclusianone
CAS RN 250275-46-8
Standard InChI InChI=1S/C33H42O4/c1-21(2)14-15-25-20-32(18-16-22(3)4)28(35)26(27(34)24-12-10-9-11-13-24)29(36)33(30(32)37,31(25,7)8)19-17-23(5)6/h9-14,16-17,25,35H,15,18-20H2,1-8H3/t25-,32?,33?/m1/s1
Standard InChI (Main Layer) InChI=1S/C33H42O4/c1-21(2)14-15-25-20-32(18-16-22(3)4)28(35)26(27(34)24-12-10-9-11-13-24)29(36)33(30(32)37,31(25,7)8)19-17-23(5)6/h9-14,16-17,25,35H,15,18-20H2,1-8H3

Cluster

Phytochemical cluster
KCF-S cluster No. 123

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL459015 CHEMBL1629877

KEGG

By LinkDB

CTD

By CAS RN