PCIDB

KNApSAcK Metabolite C00010994

Metabolite

KNApSAcK Entry

id C00010994
Name 1,1,5-Trimethyl-2-formyl-6-((E)-3-hydroxymethyl-2-butenoyloxy)-2,4-cyclohexadiene
CAS RN 33530-22-2
Standard InChI InChI=1S/C15H20O4/c1-10(8-16)7-13(18)19-14-11(2)5-6-12(9-17)15(14,3)4/h5-7,9,14,16H,8H2,1-4H3/b10-7+
Standard InChI (Main Layer) InChI=1S/C15H20O4/c1-10(8-16)7-13(18)19-14-11(2)5-6-12(9-17)15(14,3)4/h5-7,9,14,16H,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 1

Family

family name count
Apiaceae 1

List (1)

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