PCIDB

KNApSAcK Metabolite C00023766

Metabolite

KNApSAcK Entry

id C00023766
Name Cerevisterol / (-)-Cerevisteri / Ergosta-7,22-diene-5alpha,6beta,7beta-triol / (22E)-Ergosta-7,22-diene-3beta,5alpha,6beta-triol
CAS RN 516-37-0
Standard InChI InChI=1S/C28H46O3/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-15-25(30)28(31)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,17-20,22-25,29-31H,9-14,16H2,1-6H3/b8-7+/t18?,19-,20+,22-,23+,24+,25-,26-,27-,28+/m1/s1
Standard InChI (Main Layer) InChI=1S/C28H46O3/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-15-25(30)28(31)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,17-20,22-25,29-31H,9-14,16H2,1-6H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1193

Link

ChEMBL

By standard InChI CHEMBL263108
By standard InChI Main Layer CHEMBL263108 CHEMBL491545 CHEMBL491546

KEGG

By LinkDB

CTD

By CAS RN C006954