PCIDB

KNApSAcK Metabolite C00038796

Metabolite

KNApSAcK Entry

id C00038796
Name Clathsterol / (+)-Clathsterol
CAS RN 377080-84-7
Standard InChI InChI=1S/C39H66O15S2/c1-10-13-30(41)51-35(36(25(12-3)21(4)5)52-31(42)14-11-2)22(6)32-34(43)37(50-23(7)40)33-26-16-15-24-19-28(53-55(44,45)46)29(54-56(47,48)49)20-39(24,9)27(26)17-18-38(32,33)8/h21-22,24-29,32-37,43H,10-20H2,1-9H3,(H,44,45,46)(H,47,48,49)/t22-,24?,25?,26+,27-,28?,29?,32-,33+,34+,35?,36?,37+,38+,39-/m0/s1
Standard InChI (Main Layer) InChI=1S/C39H66O15S2/c1-10-13-30(41)51-35(36(25(12-3)21(4)5)52-31(42)14-11-2)22(6)32-34(43)37(50-23(7)40)33-26-16-15-24-19-28(53-55(44,45)46)29(54-56(47,48)49)20-39(24,9)27(26)17-18-38(32,33)8/h21-22,24-29,32-37,43H,10-20H2,1-9H3,(H,44,45,46)(H,47,48,49)

Cluster

Phytochemical cluster
KCF-S cluster No. 6979

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1208214

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count

Family

family name count
Microcionidae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Clathria sp. 81539 Microcionidae Metazoa