PCIDB

KNApSAcK Metabolite C00041229

Metabolite

KNApSAcK Entry

id C00041229
Name (9Z,11S,16R)-Dihydroxyoctadeca-9,17-dien-12,14-diyn-1-yl acetate
CAS RN 213905-35-2
Standard InChI InChI=1S/C20H28O4/c1-3-19(22)14-11-12-16-20(23)15-10-8-6-4-5-7-9-13-17-24-18(2)21/h3,10,15,19-20,22-23H,1,4-9,13,17H2,2H3/b15-10-/t19-,20+/m1/s1
Standard InChI (Main Layer) InChI=1S/C20H28O4/c1-3-19(22)14-11-12-16-20(23)15-10-8-6-4-5-7-9-13-17-24-18(2)21/h3,10,15,19-20,22-23H,1,4-9,13,17H2,2H3

Cluster

Phytochemical cluster
KCF-S cluster No. 2971

Link

ChEMBL

By standard InChI CHEMBL490698
By standard InChI Main Layer CHEMBL511705 CHEMBL490698 CHEMBL2204415

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
Angelica keiskei 357850 Apiaceae asterids Viridiplantae
Angelica sinensis 165353 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 CHEMBL490698 CHEMBL977663 (1) CHEMBL977664 (1)
0 / 0