PCIDB

KNApSAcK Metabolite C00036130

Metabolite

KNApSAcK Entry

id C00036130
Name Kaerophyllin
CAS RN 126574-52-5
Standard InChI InChI=1S/C21H20O6/c1-23-17-5-3-14(9-19(17)24-2)8-16-15(11-25-21(16)22)7-13-4-6-18-20(10-13)27-12-26-18/h3-6,8-10,15H,7,11-12H2,1-2H3/b16-8-/t15-/m0/s1
Standard InChI (Main Layer) InChI=1S/C21H20O6/c1-23-17-5-3-14(9-19(17)24-2)8-16-15(11-25-21(16)22)7-13-4-6-18-20(10-13)27-12-26-18/h3-6,8-10,15H,7,11-12H2,1-2H3

Cluster

Phytochemical cluster No. 21
KCF-S cluster No. 1029

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB

CTD

By CAS RN