PCIDB

KNApSAcK Metabolite C00010983

Metabolite

KNApSAcK Entry

id C00010983
Name 3-Hydroxy-4,6,6-trimethyl-1,4-Cyclohexadiene-1-carboxaldehyde 2-(hydroxymethyl)crotonate acetate
CAS RN 28333-44-0
Standard InChI InChI=1S/C17H22O5/c1-6-13(10-21-12(3)19)16(20)22-15-7-14(9-18)17(4,5)8-11(15)2/h6-9,15H,10H2,1-5H3
Standard InChI (Main Layer) InChI=1S/C17H22O5/c1-6-13(10-21-12(3)19)16(20)22-15-7-14(9-18)17(4,5)8-11(15)2/h6-9,15H,10H2,1-5H3

Cluster

Phytochemical cluster
KCF-S cluster No. 1764

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL1964794

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 hispanica 52470 Apiaceae asterids Viridiplantae