PCIDB

KNApSAcK Metabolite C00034767

Metabolite

KNApSAcK Entry

id C00034767
Name 4,5-Dehydrodiligustilide
CAS RN 884313-51-3
Standard InChI InChI=1S/C24H26O4/c1-3-5-11-20-23-13-12-15(14-19(23)22(26)27-20)17(8-4-2)24(23)18-10-7-6-9-16(18)21(25)28-24/h6-7,9-11,14-15,17H,3-5,8,12-13H2,1-2H3/b20-11-/t15-,17-,23+,24+/m1/s1
Standard InChI (Main Layer) InChI=1S/C24H26O4/c1-3-5-11-20-23-13-12-15(14-19(23)22(26)27-20)17(8-4-2)24(23)18-10-7-6-9-16(18)21(25)28-24/h6-7,9-11,14-15,17H,3-5,8,12-13H2,1-2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 3928

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL482223

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 chuanxiong 49555 Apiaceae asterids Viridiplantae

Human Protein / Gene in interaction

1 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P34969 5-hydroxytryptamine receptor 7 Serotonin receptor CHEMBL482223 CHEMBL977664 (1)
0 / 0