PCIDB

KNApSAcK Metabolite C00044472

Metabolite

KNApSAcK Entry

id C00044472
Name 6beta-Hydroxy-18-acetoxycassan-13,15-diene / (-)-6beta-Hydroxy-18-acetoxycassan-13,15-diene
CAS RN 578716-48-0
Standard InChI InChI=1S/C22H34O3/c1-6-16-8-9-18-17(14(16)2)12-19(24)20-21(4,13-25-15(3)23)10-7-11-22(18,20)5/h6,17-20,24H,1,7-13H2,2-5H3/t17-,18-,19+,20-,21-,22+/m0/s1
Standard InChI (Main Layer) InChI=1S/C22H34O3/c1-6-16-8-9-18-17(14(16)2)12-19(24)20-21(4,13-25-15(3)23)10-7-11-22(18,20)5/h6,17-20,24H,1,7-13H2,2-5H3

Cluster

Phytochemical cluster
KCF-S cluster No. 3898

Link

ChEMBL

By standard InChI CHEMBL514444
By standard InChI Main Layer CHEMBL514444

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 1

Family

family name count
Fabaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Myrospermum frutescens 100153 Fabaceae rosids Viridiplantae