PCIDB

KNApSAcK Metabolite C00014460

Metabolite

KNApSAcK Entry

id C00014460
Name Xanthoangelol F / 3'-Geranyl-2',4-dihydroxy-4'-methoxychalcone
CAS RN 265652-71-9
Standard InChI InChI=1S/C26H30O4/c1-18(2)6-5-7-19(3)8-14-23-25(30-4)17-15-22(26(23)29)24(28)16-11-20-9-12-21(27)13-10-20/h6,8-13,15-17,27,29H,5,7,14H2,1-4H3/b16-11+,19-8+
Standard InChI (Main Layer) InChI=1S/C26H30O4/c1-18(2)6-5-7-19(3)8-14-23-25(30-4)17-15-22(26(23)29)24(28)16-11-20-9-12-21(27)13-10-20/h6,8-13,15-17,27,29H,5,7,14H2,1-4H3

Cluster

Phytochemical cluster No. 13
KCF-S cluster No. 133

Link

ChEMBL

By standard InChI CHEMBL1722838
By standard InChI Main Layer CHEMBL1722838

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
Angelica keiskei 357850 Apiaceae asterids Viridiplantae

Human Protein / Gene in interaction

8 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
Q99700 Ataxin-2 Unclassified protein CHEMBL1722838 CHEMBL2114784 (1)
1 / 1
P17405 Sphingomyelin phosphodiesterase Enzyme CHEMBL1722838 CHEMBL1794495 (1)
2 / 2
P84022 Mothers against decapentaplegic homolog 3 Unclassified protein CHEMBL1722838 CHEMBL1794584 (1)
2 / 0
P43220 Glucagon-like peptide 1 receptor Glucagon-like peptide receptor CHEMBL1722838 CHEMBL2114788 (1)
0 / 0
Q9UNA4 DNA polymerase iota Enzyme CHEMBL1722838 CHEMBL1794483 (1)
0 / 0
O75164 Lysine-specific demethylase 4A Enzyme CHEMBL1722838 CHEMBL1737991 (1)
0 / 0
O75874 Isocitrate dehydrogenase [NADP] cytoplasmic Enzyme CHEMBL1722838 CHEMBL2354311 (1)
1 / 0
P01215 Glycoprotein hormones alpha chain Unclassified protein CHEMBL1722838 CHEMBL2114913 (1)
0 / 3

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (6)

OMIM preferred title UniProt
#114500 Colorectal cancer; crc P84022
#137800 Glioma susceptibility 1; glm1 O75874
#613795 Loeys-dietz syndrome, type 3; lds3 P84022
#257200 Niemann-pick disease, type a P17405
#607616 Niemann-pick disease, type b P17405
#183090 Spinocerebellar ataxia 2; sca2 Q99700

KEGG DISEASE (6)

KEGG disease name UniProt
H00081 Hashimoto's thyroiditis P01215 (marker)
H00082 Graves' disease P01215 (marker)
H00250 Congenital nongoitrous hypothyroidism (CHNG) P01215 (marker)
H00137 Niemann-Pick disease (NPD) typeA and B P17405 (related)
H00424 Defects in the degradation of sphingomyelin P17405 (related)
H00063 Spinocerebellar ataxia (SCA) Q99700 (related)