PCIDB

KNApSAcK Metabolite C00023745

Metabolite

KNApSAcK Entry

id C00023745
Name 22-Dehydrocholesterol / cis-22-Dehydrocholesterol / Cholesta-5,22-dien-3beta-ol
CAS RN 26033-10-3
Standard InChI InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h6,8-9,18-19,21-25,28H,7,10-17H2,1-5H3/b8-6-/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1
Standard InChI (Main Layer) InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h6,8-9,18-19,21-25,28H,7,10-17H2,1-5H3

Cluster

Phytochemical cluster No. 11
KCF-S cluster No. 53

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1836651

KEGG

By LinkDB

CTD

By CAS RN