PCIDB

KNApSAcK Metabolite C00010985

Metabolite

KNApSAcK Entry

id C00010985
Name 1,1,5-Trimethyl-2-formyl-4-(E)-3-hydroxymethyl-2-butenoyloxy)-2,5-cyclohexadiene
CAS RN 33579-66-7
Standard InChI InChI=1S/C15H20O4/c1-10(8-16)5-14(18)19-13-6-12(9-17)15(3,4)7-11(13)2/h5-7,9,13,16H,8H2,1-4H3/b10-5+
Standard InChI (Main Layer) InChI=1S/C15H20O4/c1-10(8-16)5-14(18)19-13-6-12(9-17)15(3,4)7-11(13)2/h5-7,9,13,16H,8H2,1-4H3

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