PCIDB

KNApSAcK Metabolite C00002252

Metabolite

KNApSAcK Entry

id C00002252
Name Irehine
CAS RN 2309-39-9
Standard InChI InChI=1S/C23H39NO/c1-15(24(4)5)19-8-9-20-18-7-6-16-14-17(25)10-12-22(16,2)21(18)11-13-23(19,20)3/h6,15,17-21,25H,7-14H2,1-5H3/t15-,17-,18-,19+,20-,21-,22-,23+/m0/s1
Standard InChI (Main Layer) InChI=1S/C23H39NO/c1-15(24(4)5)19-8-9-20-18-7-6-16-14-17(25)10-12-22(16,2)21(18)11-13-23(19,20)3/h6,15,17-21,25H,7-14H2,1-5H3

Cluster

Phytochemical cluster No. 11
KCF-S cluster No. 916

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C10810

CTD

By CAS RN