Compound Summary
3,4-DIHYDROXYBENZOIC ACID
Compound Information
3,4-DIHYDROXYBENZOIC ACID
Compound Name: | 3,4-DIHYDROXYBENZOIC ACID |
Compound CID: | 72 |
Synonyms: | 3,4-DIHYDROXYBENZOIC ACID protocatechuic acid 99-50-3 Protocatehuic acid 4-Carboxy-1,2-dihydroxybenzene More... |
Iupac Name: | 3,4-dihydroxybenzoic acid |
InChI: | InChI=1S/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11) |
InChIKey: | YQUVCSBJEUQKSH-UHFFFAOYSA-N |
Canonical Smiles: | C1=CC(=C(C=C1C(=O)O)O)O |
Isomeric Smiles: | C1=CC(=C(C=C1C(=O)O)O)O |
Molecular Weight: | 154.12 |
Molecular Formula: | C7H6O4 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
3,4-DIHYDROXYBENZOIC ACID
Molecular Weight: | 154.12 |
Molecular Formula: | C7H6O4 |
Hydrogen Bond Donor Count: | 3 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 1 |
Heavy Atom Count: | 11 |
Complexity: | 157 |
Synonyms
3,4-DIHYDROXYBENZOIC ACID
| 3,4-DIHYDROXYBENZOIC ACID | 3,4-DIHYDROXYBENZOIC ACID |
|---|---|
3,4-DIHYDROXYBENZOIC ACID |
protocatechuic acid |
99-50-3 |
Protocatehuic acid |
4-Carboxy-1,2-dihydroxybenzene |
protocatechuate |
Benzoic acid, 3,4-dihydroxy- |
4,5-Dihydroxybenzoic acid |
UNII-36R5QJ8L4B |
MFCD00002509 |
Catechol-4-carboxylic Acid |
CCRIS 6291 |
3, 4-Dihydroxybenzoic acid |
CHEMBL37537 |
MLS000737807 |
36R5QJ8L4B |
EINECS 202-760-0 |
CHEBI:36062 |
NSC 16631 |
BRN 1448841 |
1ykp |
3,4-dihydroxybenzoic acid (protocatechuic acid) |
Protocatechuic acid polymer |
3,4-Dihydroxy Benzoic Acid |
NSC16631 |
Benzoic acid, 3,4-dihydroxy- (9CI) |
DB03946 |
SMR000528167 |
C00230 |
D-3487 |
Hypogallic acid |
b-Resorcylate |
beta-Resorcylate |
4fht |
Protacatechuic Acid |
ZINCSELENITE |
Carbohydroquinonic acid |
cid_72 |
ACMC-209scu |
Protocatechuic Acid,(S) |
DSSTox_CID_1212 |
Protocatechuic acid (M1) |
bmse000328 |
3,4-dihydroxy-benzoic acid |
DSSTox_RID_76012 |
DSSTox_GSID_21212 |
SCHEMBL39435 |
3,4-Dihydroxybenzoate, VIII |
Pyrocatechol-4-carboxylic Acid |
DTXSID4021212 |
ZINC13246 |
HMS2270A17 |
KUC104409N |
ACN-S002778 |
ACT07872 |
HY-N0294 |
Tox21_200167 |
BBL012232 |
BDBM50100861 |
CP0105 |
NSC-16631 |
s3975 |
SBB061371 |
STL163570 |
AKOS000119632 |
AC-9617 |
CCG-207950 |
CS-6092 |
KSC-10-128 |
MCULE-8964889860 |
CAS-99-50-3 |
Oxidative polymer of protocatechuic acid |
NCGC00246757-01 |
NCGC00246757-02 |
NCGC00257721-01 |
AS-10808 |
SY014104 |
AB0008267 |
DB-021903 |
AM20060767 |
FT-0600028 |
N2466 |
ST50824448 |
3,4-Dihydroxybenzoic acid, >=97.0% (T) |
3,4-Dihydroxybenzoic acid, analytical standard |
F11285 |
3,4-dihydroxybenzoate;3,4-Dihydroxybenzoic acid |
002D509 |
A846038 |
AE-562/40524392 |
Q418599 |
976C8CCE-B25D-4E0A-9A6F-3CEEA7A6964F |
3,4-Dihydroxybenzoic acid, Vetec(TM) reagent grade, 97% |
Protocatechuic acid, primary pharmaceutical reference standard |
Protocatechuic acid, United States Pharmacopeia (USP) Reference Standard |
1225528-47-1 |
Experimental Data
3,4-DIHYDROXYBENZOIC ACID
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 100.000000000000000 | umol/L | 0.000000000000000 | S | N2 | 32334190 | Active | ||||||
| Caenorhabditis elegans | 780.000000000000000 | umol/L | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 100.000000000000000 | umol/L | 20.000000000000000 | 25.000000000000000 | 0.250000000000000 | S | N2 | 23780797 | |||||
| Caenorhabditis elegans | 100.000000000000000 | umol/L | S | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 100.000000000000000 | umol/L | 25.000000000000000 | S | N2 | 33683565 | |||||||
| Caenorhabditis elegans | 200.000000000000000 | umol/L | S | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 200.000000000000000 | umol/L | 38.950000000000000 | 40.000000000000000 | S | N2 | 33683565 | Active | |||||
| Saccharomyces cerevisiae | 0.002000000000000 | mg/mL | 13.000000000000000 | 18.000000000000000 | 0.380000000000000 | S | N2 | 31792269 | Active | ||||
| Caenorhabditis elegans | 200.000000000000000 | umol/L | 11.760000000000000 | 16.340000000000000 | 0.390000000000000 | 20.000000000000000 | 28.000000000000000 | 0.400000000000000 | S | N2 | 23780797 | Active | |
| Caenorhabditis elegans | 780.000000000000000 | umol/L | 20.000000000000000 | 24.000000000000000 | 0.200000000000000 | S | N2 | 31412639 | Active |
Experimental Data Visualization
3,4-DIHYDROXYBENZOIC ACID
Statistics Data
3,4-DIHYDROXYBENZOIC ACID
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 38.950000000000000 | 40.000000000000000 | 4 | 9 |
| Saccharomyces cerevisiae | 0.380000000000000 | 1 | 1 |
Statistics Data Visualization
3,4-DIHYDROXYBENZOIC ACID
