PCIDB

KNApSAcK Metabolite C00001110

Metabolite

KNApSAcK Entry

id C00001110
Name Vitexin / Apigenin 8-C-glucoside / 8-D-Glucosyl-4',5,7-trihydroxyflavone / 8-beta-D-Glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
CAS RN 3681-93-4
Standard InChI InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14?,17-,18+,19?,21+/m1/s1
Standard InChI (Main Layer) InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 22

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL487417 CHEMBL1332209 CHEMBL1357921

KEGG

By LinkDB C01460

CTD

By CAS RN

Species

Summary

Plant class

class name count
rosids 69
asterids 8
eudicotyledons 8
Liliopsida 4
Euphyllophyta 2
Spermatophyta 1
Magnoliophyta 1

Family (Top 10)

family name count
Fabaceae 58
Caryophyllaceae 6
Lamiaceae 6
Clusiaceae 3
Cucurbitaceae 2
Ranunculaceae 2
Araceae 1
Pinaceae 1
Passifloraceae 1
Cyatheaceae 1

List (93)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Acacia furcatispina 370701 Fabaceae rosids Viridiplantae
Acacia praecox 3808 Fabaceae rosids Viridiplantae
Adonis spp. 46984 Ranunculaceae eudicotyledons Viridiplantae
Anthurium versicolor 78377 Araceae Liliopsida Viridiplantae
Anthyllis subsimplex 118889 Fabaceae rosids Viridiplantae
Ascarina lucida 130721 Chloranthaceae Magnoliophyta Viridiplantae
Camellia sinensis (L.) O.KUNTZE 4441 Theaceae asterids Viridiplantae
Clinacanthus nutans 714457 Acanthaceae asterids Viridiplantae
Combretum quadrangulare 99434 Combretaceae rosids Viridiplantae
Commelina communis L 4743 Commelinaceae Liliopsida Viridiplantae
Crotalaria micans 1127386 Fabaceae rosids Viridiplantae
Crotalaria pallida 3830 Fabaceae rosids Viridiplantae
Crotalaria rotundifolia 3828 Fabaceae rosids Viridiplantae
Crotalaria verrucosa 890036 Fabaceae rosids Viridiplantae
Cucumis sativus 3659 Cucurbitaceae rosids Viridiplantae
Cyathea spp. 13470 Cyatheaceae Euphyllophyta Viridiplantae
Cytisus eriocarpus 3833 Fabaceae rosids Viridiplantae
Cytisus hirsutus 1211454 Fabaceae rosids Viridiplantae
Cytisus scoparius 3835 Fabaceae rosids Viridiplantae
Desmodium triflorum 670328 Fabaceae rosids Viridiplantae
Euphorbia supina Rafin 3977 Euphorbiaceae rosids Viridiplantae
Galactia glaucophylla 100145 Fabaceae rosids Viridiplantae
Garcinia dulcis 231905 Clusiaceae rosids Viridiplantae
Garcinia hombroniana 180107 Clusiaceae rosids Viridiplantae
Garcinia xanthochymus 198766 Clusiaceae rosids Viridiplantae
Gleditsia japonica 66093 Fabaceae rosids Viridiplantae
Gleditsia sinensis 66096 Fabaceae rosids Viridiplantae
Gleditsia triacanthos 54874 Fabaceae rosids Viridiplantae
Glycine max 3847 Fabaceae rosids Viridiplantae
Glycyrrhiza echinata 46348 Fabaceae rosids Viridiplantae
Gynostemma pentaphyllum 182084 Cucurbitaceae rosids Viridiplantae
Isodon oresbius 204130 Lamiaceae asterids Viridiplantae
Larix spp. 3325 Pinaceae Spermatophyta Viridiplantae
Lespedeza capitata 571920 Fabaceae rosids Viridiplantae
Lespedeza hedysaroides 53892 Fabaceae rosids Viridiplantae
Lespedeza juncea 688283 Fabaceae rosids Viridiplantae
Lespedeza spp. 53892 Fabaceae rosids Viridiplantae
Lupinus arboreus 3872 Fabaceae rosids Viridiplantae
Lupinus sericeus 61075 Fabaceae rosids Viridiplantae
Lupinus subcarnosus 3869 Fabaceae rosids Viridiplantae
Lupinus texensis 28959 Fabaceae rosids Viridiplantae
Lychnis flos-cuculi L. 42036 Caryophyllaceae eudicotyledons Viridiplantae
Medicago medicaginoides 70956 Fabaceae rosids Viridiplantae
Onobrychis angustifolia 3881 Fabaceae rosids Viridiplantae
Ononis spinosa 58890 Fabaceae rosids Viridiplantae
Parkinsonia aculeata 58886 Fabaceae rosids Viridiplantae
Passiflora serratodigitata 231192 Passifloraceae rosids Viridiplantae
Pelargonium reniforme 59871 Geraniaceae rosids Viridiplantae
Pennisetum americanum 4543 Poaceae Liliopsida Viridiplantae
Physocarpus capitatus 141000 Rosaceae rosids Viridiplantae
Pisum sativum 3888 Fabaceae rosids Viridiplantae
Prosopis alba 207710 Fabaceae rosids Viridiplantae
Prosopis argentina 207712 Fabaceae rosids Viridiplantae
Prosopis chilensis 35716 Fabaceae rosids Viridiplantae
Prosopis fiebrigii 3803 Fabaceae rosids Viridiplantae
Prosopis hassleri 364021 Fabaceae rosids Viridiplantae
Prosopis kuntzei 207715 Fabaceae rosids Viridiplantae
Prosopis nigra 207716 Fabaceae rosids Viridiplantae
Prosopis reptans 207717 Fabaceae rosids Viridiplantae
Prosopis ruscifolia 207718 Fabaceae rosids Viridiplantae
Prosopis spp. 3803 Fabaceae rosids Viridiplantae
Prosopis strombulifera 433934 Fabaceae rosids Viridiplantae
Prosopis vinalillo 207720 Fabaceae rosids Viridiplantae
Rhynchosia beddomei 1378005 Fabaceae rosids Viridiplantae
Rhynchosia cana 132460 Fabaceae rosids Viridiplantae
Rhynchosia capitata 132460 Fabaceae rosids Viridiplantae
Rhynchosia heynei 132460 Fabaceae rosids Viridiplantae
Rhynchosia jacobii 132460 Fabaceae rosids Viridiplantae
Rhynchosia minima 132461 Fabaceae rosids Viridiplantae
Rhynchosia rufescens 132460 Fabaceae rosids Viridiplantae
Rhynchosia suaveolens 132460 Fabaceae rosids Viridiplantae
Salvia blepharophylla 933122 Lamiaceae asterids Viridiplantae
Silene brahuica 3573 Caryophyllaceae eudicotyledons Viridiplantae
Silene multijida 3573 Caryophyllaceae eudicotyledons Viridiplantae
Silene repens 403542 Caryophyllaceae eudicotyledons Viridiplantae
Silene supina 1309628 Caryophyllaceae eudicotyledons Viridiplantae
Silene turgida 3573 Caryophyllaceae eudicotyledons Viridiplantae
Smilax bracteata 1045134 Smilacaceae Liliopsida Viridiplantae
Spartium junceum 49843 Fabaceae rosids Viridiplantae
Stachys scardica Griseb. 53171 Lamiaceae asterids Viridiplantae
Tamarindus indica 58860 Fabaceae rosids Viridiplantae
Theobroma cacao L. 3640 Malvaceae rosids Viridiplantae
Trigonella balansae 200961 Fabaceae rosids Viridiplantae
Trigonella foenum-graecum 78534 Fabaceae rosids Viridiplantae
Trigonella grandiflora 1210110 Fabaceae rosids Viridiplantae
Trollius ledebouri 46346 Ranunculaceae eudicotyledons Viridiplantae
Vigna mungo 3915 Fabaceae rosids Viridiplantae
Vigna radiata 157791 Fabaceae rosids Viridiplantae
Vigna trilobata 87086 Fabaceae rosids Viridiplantae
Vitex littoralis 54476 Lamiaceae asterids Viridiplantae
Vitex lucens 384982 Lamiaceae asterids Viridiplantae
Vitex polygama 54476 Lamiaceae asterids Viridiplantae
Vittaria anguste-elongata 38724 Pteridaceae Euphyllophyta Viridiplantae

Human Protein / Gene in interaction

16 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P10635 Cytochrome P450 2D6 Cytochrome P450 2D6 CHEMBL1357921 CHEMBL1741321 (1)
1 / 0
Q13526 Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 Enzyme CHEMBL1332209 CHEMBL1794585 (1)
0 / 0
P11712 Cytochrome P450 2C9 Cytochrome P450 2C9 CHEMBL1357921 CHEMBL1741325 (1)
0 / 1
O75496 Geminin Unclassified protein CHEMBL1332209 CHEMBL2114843 (1) CHEMBL2114780 (1)
0 / 0
P15121 Aldose reductase Enzyme CHEMBL487417 CHEMBL1942674 (1)
0 / 0
Q9Y253 DNA polymerase eta Enzyme CHEMBL1332209 CHEMBL1794569 (1)
1 / 1
Q9Y468 Lethal(3)malignant brain tumor-like protein 1 Unclassified protein CHEMBL1332209 CHEMBL1614280 (1)
0 / 0
P05177 Cytochrome P450 1A2 Cytochrome P450 1A2 CHEMBL1357921 CHEMBL1741322 (1)
0 / 0
P33261 Cytochrome P450 2C19 Cytochrome P450 2C19 CHEMBL1357921 CHEMBL1741323 (1)
1 / 1
P08684 Cytochrome P450 3A4 Cytochrome P450 3A4 CHEMBL1357921 CHEMBL1741324 (1)
0 / 1
Q9UNA4 DNA polymerase iota Enzyme CHEMBL1332209 CHEMBL1794483 (1)
0 / 0
P27695 DNA-(apurinic or apyrimidinic site) lyase Enzyme CHEMBL487417 CHEMBL1357921 CHEMBL1614211 (2)
0 / 0
Q9UBT6 DNA polymerase kappa Enzyme CHEMBL487417 CHEMBL1332209 CHEMBL1794536 (2)
0 / 0
Q13951 Core-binding factor subunit beta Unclassified protein CHEMBL487417 CHEMBL1613933 (1)
0 / 1
Q01196 Runt-related transcription factor 1 Unclassified protein CHEMBL487417 CHEMBL1613933 (1)
1 / 6
O94925 Glutaminase kidney isoform, mitochondrial Enzyme CHEMBL1332209 CHEMBL2114738 (1)
0 / 0

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (4)

OMIM preferred title UniProt
#609535 Drug metabolism, poor, cyp2c19-related P33261
#608902 Drug metabolism, poor, cyp2d6-related P10635
#601399 Platelet disorder, familial, with associated myeloid malignancy Q01196
#278750 Xeroderma pigmentosum, variant type; xpv Q9Y253

KEGG DISEASE (8)

KEGG disease name UniProt
H00036 Osteosarcoma P08684 (marker)
H01205 Coumarin resistance P11712 (related)
H01171 Poor drug metabolism (PM) P33261 (related)
H00001 Acute lymphoblastic leukemia (ALL) (precursor B lymphoblastic leukemia) Q01196 (related)
Q01196 (marker)
H00003 Acute myeloid leukemia (AML) Q01196 (related)
Q01196 (marker)
Q13951 (marker)
H00004 Chronic myeloid leukemia (CML) Q01196 (related)
H00978 Thrombocytopenia (THC) Q01196 (related)
H00403 Disorders of nucleotide excision repair Q9Y253 (related)