PCIDB

KNApSAcK Metabolite C00000185

Metabolite

KNApSAcK Entry

id C00000185
Name Typhasterol / 2-Deoxycastasterone
CAS RN 87734-68-7
Standard InChI InChI=1S/C28H48O4/c1-15(2)16(3)25(31)26(32)17(4)20-7-8-21-19-14-24(30)23-13-18(29)9-11-28(23,6)22(19)10-12-27(20,21)5/h15-23,25-26,29,31-32H,7-14H2,1-6H3/t16-,17-,18+,19-,20+,21-,22-,23+,25+,26+,27+,28+/m0/s1
Standard InChI (Main Layer) InChI=1S/C28H48O4/c1-15(2)16(3)25(31)26(32)17(4)20-7-8-21-19-14-24(30)23-13-18(29)9-11-28(23,6)22(19)10-12-27(20,21)5/h15-23,25-26,29,31-32H,7-14H2,1-6H3

Cluster

Phytochemical cluster No. 11
KCF-S cluster No. 68

Link

ChEMBL

By standard InChI
By standard InChI Main Layer

KEGG

By LinkDB C15793

CTD

By CAS RN