KNApSAcK Metabolite C00044046
Metabolite
KNApSAcK Entry
| id | C00044046 |
|---|---|
| Name | 1,5-Di-O-caffeoylquinic acid |
| CAS RN | 212891-05-9 |
| Standard InChI | InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(24(34)35,11-19(30)23(20)33)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,33H,11-12H2,(H,34,35)/b7-3+,8-4+/t19-,20-,23+,25-/m1/s1 |
| Standard InChI (Main Layer) | InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(24(34)35,11-19(30)23(20)33)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,33H,11-12H2,(H,34,35) |
Cluster
| Phytochemical cluster | No. 6 |
|---|---|
| KCF-S cluster | No. 518 |
Link
ChEMBL
| By standard InChI | CHEMBL487258 |
|---|---|
| By standard InChI Main Layer | CHEMBL431948 CHEMBL487258 CHEMBL478574 CHEMBL1213299 CHEMBL2105478 CHEMBL2356300 |
KEGG
| By LinkDB | C10445 |
|---|
CTD
| By CAS RN |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| asterids | 1 |
Family
| family name | count |
|---|---|
| Asteraceae | 1 |
List (1)
* NCBI
| KNApSAcK organism | *ID | *family | *plant class | *kingdom |
|---|---|---|---|---|
| Xanthium strumarium | 318068 | Asteraceae | asterids | Viridiplantae |
Human Protein / Gene in interaction
6 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P40763 | Signal transducer and activator of transcription 3 | Transcription Factor | CHEMBL487258 |
CHEMBL1029438
(1)
|
1 / 2 |
| P12931 | Proto-oncogene tyrosine-protein kinase Src | Src | CHEMBL487258 |
CHEMBL1024397
(1)
|
0 / 0 |
| P51692 | Signal transducer and activator of transcription 5B | Unclassified protein | CHEMBL487258 |
CHEMBL1029439
(1)
|
1 / 1 |
| P06239 | Tyrosine-protein kinase Lck | Src | CHEMBL487258 |
CHEMBL1024396
(1)
|
0 / 1 |
| P24298 | Alanine aminotransferase 1 | Enzyme | CHEMBL487258 |
CHEMBL1020961
(1)
CHEMBL1020962
(1)
|
0 / 0 |
| P42224 | Signal transducer and activator of transcription 1-alpha/beta | Unclassified protein | CHEMBL487258 |
CHEMBL1024398
(1)
|
3 / 3 |
Related Disease
Diseases related to proteins in ChEMBL interactions
OMIM (5)
| OMIM | preferred title | UniProt |
|---|---|---|
| #209950 | Atypical mycobacteriosis, familial |
P42224
|
| #614162 | Candidiasis, familial, 7; candf7 |
P42224
|
| #245590 | Growth hormone insensitivity with immunodeficiency |
P51692
|
| #147060 | Hyper-ige recurrent infection syndrome, autosomal dominant |
P40763
|
| #613796 | Mycobacterial and viral infections, susceptibility to, autosomal recessive |
P42224
|
KEGG DISEASE (7)
| KEGG | disease name | UniProt |
|---|---|---|
| H00093 | Combined immunodeficiencies (CIDs) |
P06239
(related)
|
| H00016 | Oral cancer |
P40763
(related)
|
| H00107 | Other well-defined immunodeficiency syndromes |
P40763
(related)
|
| H00089 | IFN-gamma/IL-12 axis |
P42224
(related)
|
| H00363 | Candidiasis |
P42224
(related)
|
| H01109 | Chronic mucocutaneous candidiasis (CMC) |
P42224
(related)
|
| H00931 | Growth hormone insensitivity with immunodeficiency |
P51692
(related)
|