PCIDB

KNApSAcK Metabolite C00002518

Metabolite

KNApSAcK Entry

id C00002518
Name Daidzin / Daidzoside / Daidzein 7-O-glucoside
CAS RN 552-66-9
Standard InChI InChI=1S/C21H20O9/c22-8-16-18(25)19(26)20(27)21(30-16)29-12-5-6-13-15(7-12)28-9-14(17(13)24)10-1-3-11(23)4-2-10/h1-7,9,16,18-23,25-27H,8H2/t16?,18-,19+,20?,21-/m1/s1
Standard InChI (Main Layer) InChI=1S/C21H20O9/c22-8-16-18(25)19(26)20(27)21(30-16)29-12-5-6-13-15(7-12)28-9-14(17(13)24)10-1-3-11(23)4-2-10/h1-7,9,16,18-23,25-27H,8H2

Cluster

Phytochemical cluster No. 15
KCF-S cluster No. 2

Link

ChEMBL

By standard InChI
By standard InChI Main Layer CHEMBL486422

KEGG

By LinkDB C10216

CTD

By CAS RN C013908

Species

Summary

Plant class

class name count
rosids 26
eudicotyledons 1

Family

family name count
Fabaceae 25
Streptomycetaceae 1
Begoniaceae 1
Amaranthaceae 1

List (28)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Baptisia arachnifera 49796 Fabaceae rosids Viridiplantae
Baptisia bracteata 313912 Fabaceae rosids Viridiplantae
Baptisia calycosa 49796 Fabaceae rosids Viridiplantae
Baptisia cinerea 313913 Fabaceae rosids Viridiplantae
Baptisia lanceolata 49796 Fabaceae rosids Viridiplantae
Baptisia lecontei 49796 Fabaceae rosids Viridiplantae
Baptisia megacarpa 49796 Fabaceae rosids Viridiplantae
Baptisia nuttalliana 49796 Fabaceae rosids Viridiplantae
Baptisia perfoliata 49796 Fabaceae rosids Viridiplantae
Baptisia simplicifolia 49796 Fabaceae rosids Viridiplantae
Begonia nantoensis 78253 Begoniaceae rosids Viridiplantae
Bituminaria acaulis 53835 Fabaceae rosids Viridiplantae
Froelichia floridana 46114 Amaranthaceae eudicotyledons Viridiplantae
Genista lydia 529822 Fabaceae rosids Viridiplantae
Glycine max 3847 Fabaceae rosids Viridiplantae
Medicago truncatula 3880 Fabaceae rosids Viridiplantae
Pueraria lobata 3893 Fabaceae rosids Viridiplantae
Pueraria mirifica 861244 Fabaceae rosids Viridiplantae
Pueraria spp. 3892 Fabaceae rosids Viridiplantae
Pueraria tuberosa 457826 Fabaceae rosids Viridiplantae
Retama sphaerocarpa 49838 Fabaceae rosids Viridiplantae
Streptoverticillium album K-251 1883 Streptomycetaceae Bacteria
Thermopsis macrophylla 114322 Fabaceae rosids Viridiplantae
Thermopsis mollis 49852 Fabaceae rosids Viridiplantae
Thermopsis rhombifolia 61122 Fabaceae rosids Viridiplantae
Thermopsis villosa 114325 Fabaceae rosids Viridiplantae
Trifolium pratense 57577 Fabaceae rosids Viridiplantae
Vigna radiata 157791 Fabaceae rosids Viridiplantae

Human Protein / Gene in interaction

11 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P04637 Cellular tumor antigen p53 Transcription Factor CHEMBL486422 CHEMBL1738132 (1)
7 / 44
Q16637 Survival motor neuron protein Unclassified protein CHEMBL486422 CHEMBL1613842 (1)
4 / 2
P05091 Aldehyde dehydrogenase, mitochondrial Oxidoreductase CHEMBL486422 CHEMBL641008 (1) CHEMBL641141 (1)
CHEMBL693590 (1) CHEMBL693591 (1)
CHEMBL693592 (1) CHEMBL693593 (1)
1 / 1
P51151 Ras-related protein Rab-9A Unclassified protein CHEMBL486422 CHEMBL1613838 (1)
0 / 0
P38398 Breast cancer type 1 susceptibility protein Enzyme CHEMBL486422 CHEMBL2114807 (1)
4 / 2
P83916 Chromobox protein homolog 1 Unclassified protein CHEMBL486422 CHEMBL1794401 (1)
0 / 0
O15118 Niemann-Pick C1 protein Unclassified protein CHEMBL486422 CHEMBL1614342 (1)
1 / 1
Q96QE3 ATPase family AAA domain-containing protein 5 Unclassified protein CHEMBL486422 CHEMBL1738588 (1) CHEMBL1738317 (1)
0 / 0
Q9UBT6 DNA polymerase kappa Enzyme CHEMBL486422 CHEMBL1794536 (1)
0 / 0
P27338 Amine oxidase [flavin-containing] B Oxidoreductase CHEMBL486422 CHEMBL879881 (1) CHEMBL689869 (1)
CHEMBL689870 (1) CHEMBL689871 (1)
CHEMBL731144 (1) CHEMBL731146 (1)
0 / 0
P21397 Amine oxidase [flavin-containing] A Oxidoreductase CHEMBL486422 CHEMBL879881 (1) CHEMBL689869 (1)
CHEMBL689870 (1) CHEMBL689871 (1)
CHEMBL731144 (1) CHEMBL731146 (1)
1 / 1

CTD interaction (4)

compound gene gene name gene description interaction interaction type form reference
pmid
C013908 217 ALDH2
ALDH-E2
ALDHI
ALDM
aldehyde dehydrogenase 2 family (mitochondrial) (EC:1.2.1.3) daidzin inhibits the reaction [ALDH2 protein results in increased hydrolysis of 4-nitrophenyl acetate] decreases reaction
/ increases hydrolysis
protein 21349255
C013908 217 ALDH2
ALDH-E2
ALDHI
ALDM
aldehyde dehydrogenase 2 family (mitochondrial) (EC:1.2.1.3) daidzin inhibits the reaction [ALDH2 protein results in increased oxidation of propionaldehyde] decreases reaction
/ increases oxidation
protein 21349255
C013908 2353 FOS
AP-1
C-FOS
p55
FBJ murine osteosarcoma viral oncogene homolog daidzin results in increased expression of FOS mRNA increases expression
mRNA 17142977
C013908 5241 PGR
NR3C3
PR
progesterone receptor daidzin results in increased expression of PGR protein increases expression
protein 17142977

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (18)

OMIM preferred title UniProt
#202300 Adrenocortical carcinoma, hereditary; adcc P04637
#610251 Alcohol sensitivity, acute P05091
#614740 Basal cell carcinoma, susceptibility to, 7; bcc7 P04637
#114480 Breast cancer P38398
#604370 Breast-ovarian cancer, familial, susceptibility to, 1; brovca1 P38398
#300615 Brunner syndrome P21397
#133239 Esophageal cancer P04637
#151623 Li-fraumeni syndrome 1; lfs1 P04637
#211980 Lung cancer P04637
#257220 Niemann-pick disease, type c1; npc1 O15118
#167000 Ovarian cancer P38398
#614320 Pancreatic cancer, susceptibility to, 4; pnca4 P38398
#260500 Papilloma of choroid plexus; cpp P04637
#253300 Spinal muscular atrophy, type i; sma1 Q16637
#253550 Spinal muscular atrophy, type ii; sma2 Q16637
#253400 Spinal muscular atrophy, type iii; sma3 Q16637
#271150 Spinal muscular atrophy, type iv; sma4 Q16637
#275355 Squamous cell carcinoma, head and neck; hnscc P04637

KEGG DISEASE (41)

KEGG disease name UniProt
H00136 Niemann-Pick disease type C (NPC) O15118 (related)
H00004 Chronic myeloid leukemia (CML) P04637 (related)
H00005 Chronic lymphocytic leukemia (CLL) P04637 (related)
H00006 Hairy-cell leukemia P04637 (related)
H00008 Burkitt lymphoma P04637 (related)
H00009 Adult T-cell leukemia P04637 (related)
H00010 Multiple myeloma P04637 (related)
H00013 Small cell lung cancer P04637 (related)
H00014 Non-small cell lung cancer P04637 (related)
H00015 Malignant pleural mesothelioma P04637 (related)
H00016 Oral cancer P04637 (related)
P04637 (marker)
H00017 Esophageal cancer P04637 (related)
P04637 (marker)
H00018 Gastric cancer P04637 (related)
H00019 Pancreatic cancer P04637 (related)
P04637 (marker)
H00020 Colorectal cancer P04637 (related)
P04637 (marker)
H00022 Bladder cancer P04637 (related)
H00025 Penile cancer P04637 (related)
P04637 (marker)
H00026 Endometrial Cancer P04637 (related)
H00027 Ovarian cancer P04637 (related)
P38398 (related)
H00028 Choriocarcinoma P04637 (related)
H00029 Vulvar cancer P04637 (related)
H00031 Breast cancer P04637 (related)
P38398 (related)
H00032 Thyroid cancer P04637 (related)
H00033 Adrenal carcinoma P04637 (related)
H00036 Osteosarcoma P04637 (related)
H00038 Malignant melanoma P04637 (related)
H00039 Basal cell carcinoma P04637 (related)
H00040 Squamous cell carcinoma P04637 (related)
H00041 Kaposi's sarcoma P04637 (related)
H00042 Glioma P04637 (related)
P04637 (marker)
H00044 Cancer of the anal canal P04637 (related)
H00046 Cholangiocarcinoma P04637 (related)
H00047 Gallbladder cancer P04637 (related)
H00048 Hepatocellular carcinoma P04637 (related)
H00055 Laryngeal cancer P04637 (related)
P04637 (marker)
H00881 Li-Fraumeni syndrome P04637 (related)
H01007 Choroid plexus papilloma P04637 (related)
H00021 Renal cell carcinoma P04637 (marker)
H01071 Acute alcohol sensitivity P05091 (related)
H00548 Brunner syndrome P21397 (related)
H00455 Spinal muscular atrophy (SMA) Q16637 (related)
Q16637 (related)

Diseases related to CTD interactions

2 disease from interactions of metabolites

MeSH disease OMIM compound disease name evidence type reference
pmid
D008569 C013908 Memory Disorders therapeutic
21052945
D011471 C013908 Prostatic Neoplasms therapeutic
10965018