PCIDB

KNApSAcK Metabolite C00004603

Metabolite

KNApSAcK Entry

id C00004603
Name Penduletin / 5,4'-Dihydroxy-3,6,7-trimethoxyflavone / 5-Hydroxy-2-(4-hydroxyphenyl)-3,6,7-trimethoxy-4H-1-benzopyran-4-one
CAS RN 569-80-2
Standard InChI InChI=1S/C18H16O7/c1-22-12-8-11-13(14(20)17(12)23-2)15(21)18(24-3)16(25-11)9-4-6-10(19)7-5-9/h4-8,19-20H,1-3H3
Standard InChI (Main Layer) InChI=1S/C18H16O7/c1-22-12-8-11-13(14(20)17(12)23-2)15(21)18(24-3)16(25-11)9-4-6-10(19)7-5-9/h4-8,19-20H,1-3H3

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 3

Link

ChEMBL

By standard InChI CHEMBL165509
By standard InChI Main Layer CHEMBL165509

KEGG

By LinkDB

CTD

By CAS RN

Species

Summary

Plant class

class name count
asterids 24
rosids 6
eudicotyledons 3

Family (Top 10)

family name count
Asteraceae 19
Lamiaceae 3
Saxifragaceae 2
Fabaceae 2
Betulaceae 1
Sapindaceae 1
Rutaceae 1
Cleomaceae 1
Verbenaceae 1
Crassulaceae 1

List (33)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Achillea ageratum 282717 Asteraceae asterids Viridiplantae
Achillea clavennae 282726 Asteraceae asterids Viridiplantae
Achillea nana 282752 Asteraceae asterids Viridiplantae
Aeonium spp. 22994 Crassulaceae eudicotyledons Viridiplantae
Ageratina espinosara 102749 Asteraceae asterids Viridiplantae
Alkanna orientalis 543563 Boraginaceae asterids Viridiplantae
Artemisia annua 35608 Asteraceae asterids Viridiplantae
Baccharis pedunculata 1123534 Asteraceae asterids Viridiplantae
Baccharis trinervis 573714 Asteraceae asterids Viridiplantae
Betula nigra 3508 Betulaceae rosids Viridiplantae
Brickellia eupatorioides 102754 Asteraceae asterids Viridiplantae
Brickellia pendula 102753 Asteraceae asterids Viridiplantae
Callicarpa pilosissima 21922 Lamiaceae asterids Viridiplantae
Chrysosplenium alternifolium 80774 Saxifragaceae eudicotyledons Viridiplantae
Chrysosplenium tetrandum 40784 Saxifragaceae eudicotyledons Viridiplantae
Cleome droserifolia 511510 Cleomaceae rosids Viridiplantae
Dictamnus albus 298346 Rutaceae rosids Viridiplantae
Dodonaea viscosa 151065 Sapindaceae rosids Viridiplantae
Eupatorium areolare 13516 Asteraceae asterids Viridiplantae
Flourensia cernua 191157 Asteraceae asterids Viridiplantae
Grindelia robusta 1114741 Asteraceae asterids Viridiplantae
Grindelia tarapacana 1114766 Asteraceae asterids Viridiplantae
Jasonia tuberosa 56533 Asteraceae asterids Viridiplantae
Lagophylla glandulosa 349395 Asteraceae asterids Viridiplantae
Lantana achyranthifolia 87005 Verbenaceae asterids Viridiplantae
Meriandra benghalensis 392635 Lamiaceae asterids Viridiplantae
Oncosiphon grandiflorum 99086 Asteraceae asterids Viridiplantae
Ononis speciosa 798039 Fabaceae rosids Viridiplantae
Parthenium rollinsianum 35934 Asteraceae asterids Viridiplantae
Plectranthus rugosus 41227 Lamiaceae asterids Viridiplantae
Tanacetum polycephalum 944772 Asteraceae asterids Viridiplantae
Tephrosia candida 587868 Fabaceae rosids Viridiplantae
Trixis vanthrei 41654 Asteraceae asterids Viridiplantae

Human Protein / Gene in interaction

3 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P08183 Multidrug resistance protein 1 drug CHEMBL165509 CHEMBL1687396 (1)
1 / 0
P15121 Aldose reductase Enzyme CHEMBL165509 CHEMBL1036011 (1) CHEMBL1036012 (1)
CHEMBL1036013 (1) CHEMBL1036014 (1)
0 / 0
Q9UNQ0 ATP-binding cassette sub-family G member 2 ATP binding cassette CHEMBL165509 CHEMBL1687393 (1) CHEMBL1687394 (1)
2 / 0

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (3)

OMIM preferred title UniProt
#614490 Blood group, junior system; jr Q9UNQ0
#612244 Inflammatory bowel disease 13; ibd13 P08183
#138900 Uric acid concentration, serum, quantitative trait locus 1; uaqtl1 Q9UNQ0