MAE

MALEIC ACID

Created:	1999-07-08
Last modified:	2011-06-04

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38 entries where MAE is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	12
Chiral Atom Count	0
Bond Count	11
Aromatic Bond Count	0

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Chemical Component Summary
Name	MALEIC ACID
Systematic Name (OpenEye OEToolkits)	but-2-enedioic acid
Formula	C₄ H₄ O₄
Molecular Weight	116.072
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(O)\C=C/C(=O)O
SMILES	CACTVS	3.341	OC(=O)C=CC(O)=O
SMILES	OpenEye OEToolkits	1.5.0	C(=CC(=O)O)C(=O)O
Canonical SMILES	CACTVS	3.341	OC(=O)\C=C/C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	C(=C/C(=O)O)/C(=O)O
InChI	InChI	1.03	InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1-
InChIKey	InChI	1.03	VZCYOOQTPOCHFL-UPHRSURJSA-N

Drug Info: DrugBank

DrugBank ID	DB04299
Name	Maleic acid
Groups	experimental
Synonyms	cis-1,2-ethylenedicarboxylic acid (Z)-2-butenedioic acid cis-but-2-enedioic acid cis-Butenedioic acid Maleic acid Toxilic acid (Z)-butenedioic acid
Categories	Acid Etching, Dental Acids, Acyclic Dicarboxylic Acids Enzyme Inhibitors
CAS number	110-16-7

Drug Targets

Name	Target Sequence	Pharmacological Action
Aspartate aminotransferase	MFENITAAPADPILGLADLFRADERPGKINLGIGVYKDETGKTPVLTSVK...	unknown
Trypanothione reductase	MMSKIFDLVVIGAGSGGLEAAWNAATLYKKRVAVIDVQMVHGPPFFSALG...	unknown
Aspartate aminotransferase	MRGLSRRVQAMKPSATVAVNAKALELRRQGVDLVALTAGEPDFDTPEHVK...	unknown
Aromatic-amino-acid aminotransferase	MLGNLKPQAPDKILALMGEFRADPRQGKIDLGVGVYKDATGHTPIMRAVH...	unknown
Aspartate aminotransferase, cytoplasmic	MAPPSVFAEVPQAQPVLVFKLTADFREDPDPRKVNLGVGAYRTDDCHPWV...	unknown

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