PCIDB

KNApSAcK Metabolite C00036857

Metabolite

KNApSAcK Entry

id C00036857
Name Caesalmin B / (+)-Caesalmin B
CAS RN 352658-23-2
Standard InChI InChI=1S/C22H28O6/c1-11(23)27-16-5-7-20(2,3)22(25)10-15-18-13(21(16,22)4)9-14-12(6-8-26-14)17(18)19(24)28-15/h6,8,13,15-18,25H,5,7,9-10H2,1-4H3/t13-,15-,16-,17+,18-,21-,22+/m0/s1
Standard InChI (Main Layer) InChI=1S/C22H28O6/c1-11(23)27-16-5-7-20(2,3)22(25)10-15-18-13(21(16,22)4)9-14-12(6-8-26-14)17(18)19(24)28-15/h6,8,13,15-18,25H,5,7,9-10H2,1-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 146

Link

ChEMBL

By standard InChI CHEMBL457149
By standard InChI Main Layer CHEMBL457149

KEGG

By LinkDB

CTD

By CAS RN