PCIDB

KNApSAcK Metabolite C00037111

Metabolite

KNApSAcK Entry

id C00037111
Name Episamarcandin
CAS RN 61490-17-3
Standard InChI InChI=1S/C24H32O5/c1-22(2)18-9-12-24(4,27)19(23(18,3)11-10-20(22)25)14-28-16-7-5-15-6-8-21(26)29-17(15)13-16/h5-8,13,18-20,25,27H,9-12,14H2,1-4H3/t18-,19?,20-,23-,24?/m0/s1
Standard InChI (Main Layer) InChI=1S/C24H32O5/c1-22(2)18-9-12-24(4,27)19(23(18,3)11-10-20(22)25)14-28-16-7-5-15-6-8-21(26)29-17(15)13-16/h5-8,13,18-20,25,27H,9-12,14H2,1-4H3

Cluster

Phytochemical cluster
KCF-S cluster No. 209

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL177857 CHEMBL1987589

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 1

Family

family name count
Apiaceae 1

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ferula assa-foetida 52471 Apiaceae asterids Viridiplantae