KNApSAcK Metabolite C00002682
Metabolite
KNApSAcK Entry
| id | C00002682 |
|---|---|
| Name | Vanillic acid / 3-Methoxy-4-hydroxybenzoic acid |
| CAS RN | 121-34-6 |
| Standard InChI | InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11) |
| Standard InChI (Main Layer) | InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11) |
Cluster
| Phytochemical cluster | |
|---|---|
| KCF-S cluster | No. 1073 |
Link
ChEMBL
| By standard InChI | CHEMBL120568 |
|---|---|
| By standard InChI Main Layer | CHEMBL120568 |
KEGG
| By LinkDB | C06672 |
|---|
CTD
| By CAS RN | D014641 |
|---|
Species
Summary
Plant class
| class name | count |
|---|---|
| rosids | 28 |
| asterids | 20 |
| Liliopsida | 8 |
| eudicotyledons | 6 |
| Magnoliophyta | 5 |
| Spermatophyta | 4 |
| Euphyllophyta | 1 |
| Embryophyta | 1 |
Family (Top 10)
| family name | count |
|---|---|
| Rutaceae | 6 |
| Plantaginaceae | 4 |
| Asteraceae | 4 |
| Pinaceae | 3 |
| Lamiaceae | 3 |
| Fabaceae | 3 |
| Celastraceae | 2 |
| Aristolochiaceae | 2 |
| Malvaceae | 2 |
| Piperaceae | 2 |
List (79)
* NCBI
Human Protein / Gene in interaction
5 ChEMBL Protein in interactions
| accession | description | class description | compound | assay ID (# of activities) |
# of diseases
(OMIM / KEGG) |
|---|---|---|---|---|---|
| P42858 | Huntingtin | Unclassified protein | CHEMBL120568 |
CHEMBL1613918
(1)
|
1 / 1 |
| P15121 | Aldose reductase | Enzyme | CHEMBL120568 |
CHEMBL1942675
(1)
|
0 / 0 |
| P03372 | Estrogen receptor | NR3A1 | CHEMBL120568 |
CHEMBL1941568
(1)
CHEMBL1941569
(1)
|
1 / 1 |
| P51580 | Thiopurine S-methyltransferase | Enzyme | CHEMBL120568 |
CHEMBL814140
(1)
|
1 / 1 |
| Q9UNA4 | DNA polymerase iota | Enzyme | CHEMBL120568 |
CHEMBL1794483
(1)
|
0 / 0 |
CTD interaction (5)
| compound | gene | gene name | gene description | interaction | interaction type | form |
reference
pmid |
|---|---|---|---|---|---|---|---|
| D014641 | 4846 |
NOS3
ECNOS eNOS |
nitric oxide synthase 3 (endothelial cell) (EC:1.14.13.39) | Vanillic Acid results in increased expression of NOS3 mRNA |
increases expression
|
mRNA |
15740983
|
| D014641 | 54575 |
UGT1A10
UDPGT UGT-1J UGT1-10 UGT1.10 UGT1J |
UDP glucuronosyltransferase 1 family, polypeptide A10 (EC:2.4.1.17) | UGT1A10 protein results in increased glucuronidation of Vanillic Acid |
increases glucuronidation
|
protein |
15117964
|
| D014641 | 54659 |
UGT1A3
UDPGT UDPGT_1-3 UGT-1C UGT1-03 UGT1.3 UGT1C |
UDP glucuronosyltransferase 1 family, polypeptide A3 (EC:2.4.1.17) | UGT1A3 protein results in increased glucuronidation of Vanillic Acid |
increases glucuronidation
|
protein |
15117964
|
| D014641 | 54577 |
UGT1A7
UDPGT UDPGT_1-7 UGT-1G UGT1-07 UGT1.7 UGT1G |
UDP glucuronosyltransferase 1 family, polypeptide A7 (EC:2.4.1.17) | UGT1A7 protein results in increased glucuronidation of Vanillic Acid |
increases glucuronidation
|
protein |
15117964
|
| D014641 | 54576 |
UGT1A8
UDPGT UDPGT_1-8 UGT-1H UGT1-08 UGT1.8 UGT1A8S UGT1H |
UDP glucuronosyltransferase 1 family, polypeptide A8 (EC:2.4.1.17) | UGT1A8 protein results in increased glucuronidation of Vanillic Acid |
increases glucuronidation
|
protein |
15117964
|