OXD

OXALIC ACID

Created:	2003-06-20
Last modified:	2024-09-27

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18 entries where OXD is found as a standalone ligand1 entries where OXD is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	8
Chiral Atom Count	0
Bond Count	7
Aromatic Bond Count	0

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Chemical Component Summary
Name	OXALIC ACID
Systematic Name (OpenEye OEToolkits)	ethanedioic acid
Formula	C₂ H₂ O₄
Molecular Weight	90.035
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(O)C(=O)O
SMILES	CACTVS	3.341	OC(=O)C(O)=O
SMILES	OpenEye OEToolkits	1.5.0	C(=O)(C(=O)O)O
Canonical SMILES	CACTVS	3.341	OC(=O)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	C(=O)(C(=O)O)O
InChI	InChI	1.03	InChI=1S/C2H2O4/c3-1(4)2(5)6/h(H,3,4)(H,5,6)
InChIKey	InChI	1.03	MUBZPKHOEPUJKR-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank ID	DB03902
Name	Oxalic Acid
Groups	experimental
Description	A strong dicarboxylic acid occurring in many plants and vegetables. It is produced in the body by metabolism of glyoxylic acid or ascorbic acid. It is not metabolized but excreted in the urine. It is used as an analytical reagent and general reducing agent. [PubChem]
Synonyms	Oxalic Acid
Categories	Acids, Acyclic Compounds used in a research, industrial, or household setting Dicarboxylic Acids Indicators and Reagents Laboratory Chemicals OAT3/SLC22A8 Substrates Organic Anion Transporting Polypeptide 2B1 Inhibitors Oxalates Reducing Agents
CAS number	144-62-7

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Proto-oncogene tyrosine-protein kinase Src	MGSNKSKPKDASQRRRSLEPAENVHGAGGGAFPASQTPSKPASADGHRGP...	unknown
Solute carrier organic anion transporter family member 2B1	MGPRIGPAGEVPQVPDKETKATMGTENTPGGKASPDPQDVRPSVFHNIKL...	unknown	inhibitor
Solute carrier family 22 member 8	MTFSEILDRVGSMGHFQFLHVAILGLPILNMANHNLLQIFTAATPVHHCR...	unknown	substrate

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource Name	Reference
PubChem	18676629, 971, 3819775
ChEMBL	CHEMBL146755
ChEBI	CHEBI:16995
CCDC/CSD	COZYOG02, ATOXAL02, BAHOXH01, BUJSIL01, ATOXAL04, EXECEP, EGARAI, BOVKAZ, BUJSIL, ATOXAL03, FIJROI, ECOBEF, BUCRID, COZYOG03, DEMYAV, AYUMEN, COZYOG04, FOTHIF, DEFCUM01, DEFCUM, DUVLUB, EZIDIB, ATOXAL01, FASSOK, COZYOG05, DUDKAO, AHETIQ, FIBCUR01, AHESOV, BEYDAL, AHESIP, ACESEI, ECOBAB, COGREV, FOTDUP, COZYOG01, FAFHEC, COZYOG, EMAPEP, BAHDEU, AHETEM, CUVDIH, ATOXAL, ADAQEE
COD	2105666, 2105667, 2105668, 2300356, 4516514, 2310115, 2310114, 2310117, 2310116, 2310118, 2310119, 2310120, 2310121, 2310122, 2310123, 2310124, 2310125, 2310126, 2310127, 4116139, 4507987, 4507988, 4507989, 4507990, 4507991