PCIDB

KNApSAcK Metabolite C00010984

Metabolite

KNApSAcK Entry

id C00010984
Name 3-Hydroxy-4,6,6-trimethyl-1,4-Cyclohexadiene-1-carboxaldehyde 4-hydroxy-3-methylcrotonate acetate
CAS RN 28333-41-7
Standard InChI InChI=1S/C17H22O5/c1-11(10-21-13(3)19)6-16(20)22-15-7-14(9-18)17(4,5)8-12(15)2/h6-9,15H,10H2,1-5H3
Standard InChI (Main Layer) InChI=1S/C17H22O5/c1-11(10-21-13(3)19)6-16(20)22-15-7-14(9-18)17(4,5)8-12(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

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 2

Family

family name count
Apiaceae 2

List (2)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Ligusticum seguieri 49551 Apiaceae asterids Viridiplantae
Selinum carvifolium 40938 Apiaceae asterids Viridiplantae