Small Molecule fumarate

URN	urn:agi-cas:110-17-8
Connectivity	59
Name	fumarate

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Pathway	Tricarboxylic acid cycle
	Phenylalanine and Tyrosine metabolism
	Urea cycle and arginine metabolism
	Aspartate metabolism
	Purine metabolism
	Respiratory chain and oxidative phosphorylation
	Urea Cycle Pathway
	Urea Cycle Pathway
	urea cycle pathway
	citrate cycle pathway
	'Copy of 'de novo purine biosynthetic pathway'
	de novo purine biosynthetic pathwaylatest
	Copy of 'de novo purine biosynthetic pathwaylatest'
	Copy of 'de novo purine biosynthetic pathwaylatest'
	citric acid cycle pathway
	altered hypoxia inducible factor pathway

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IUPAC Name	maleic acid
	fumaric acid
	fumarate
	sodium (E)-4-hydroxy-4-keto-but-2-enoate
	disodium fumarate
	disodium maleate

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InChIKey	VZCYOOQTPOCHFL-UPHRSURJSA-N
	VZCYOOQTPOCHFL-OWOJBTEDSA-N
	VZCYOOQTPOCHFL-OWOJBTEDSA-L
	VRVKOZSIJXBAJG-TYYBGVCCSA-M
	MSJMDZAOKORVFC-SEPHDYHBSA-L
	MSJMDZAOKORVFC-UAIGNFCESA-L

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Rotatable Bond Count	2

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MedScan ID	1182233

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ChEBI ID	18012
	29806

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Molecular Weight	116.072160
	114.056280
	138.053990
	160.035820
	116.072160
	114.056280
	160.035820
	137.046050
	116.072160
	114.056280
	160.035820
	137.046050

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CAS ID	110-17-8
	623158-97-4
	6915-18-0
	17013-01-3
	7704-73-6
	142-42-7
	5873-57-4
	68307-91-5

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KEGG ID	C00122

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Alias	(e)-2-butenedioic acid
	(E)-HO2CCH=CHCO2H
	[(14) C]fumarate
	[U-(13) C]fumarate
	1,2-Ethenedicarboxylic acid, trans-
	1,2-ethylenedicarboxylic acid
	1,2-Ethylenedicarboxylic acid, (E)
	2-Butenedioic acid (2E)-
	2-Butenedioic acid (E)-
	2-Butenedioic acid (E)-, disodium salt
	2-Butenedioic acid (E)-, ion(2-)
	2-Butenedioic acid (E)-, sodium salt
	acide fumarique
	AI3-24236
	Allomaleic acid
	Allomalenic acid
	ammonium fumarate
	Boletic acid
	BRN 0605763
	Butene-1,4-dioic acid
	Butenedioic acid
	Butenedioic acid, (E)-
	Caswell No. 465E
	CCRIS 1039
	CCRIS 7315
	Disodium fumarate
	EINECS 203-743-0
	EINECS 227-535-4
	EINECS 231-725-2
	EINECS 241-087-7
	EPA Pesticide Chemical Code 051201
	FEMA No. 2488
	fema number: 2488
	Fumaran sodny
	fumarate
	Fumarate dianion
	Fumarate(2-)
	fumaric acid
	fumaric acid (e)-butenedioic acid trans-1,2-ethylenedicarboxylic acid allomaleic acid boletic acid
	fumaric acid, disodium salt
	Fumaric acid, ion(2-)
	Fumaric acid, sodium salt
	HSDB 710
	Kyselina fumarova
	Lichenic acid
	Maleic anhydride, mono(castor oil) ester
	Monosodium fumarate
	NSC 2752
	NSC-2752
	Sodium 2-butenedioate, (E)-
	Sodium fumarate
	Sodium fumarate (x-Na)
	Sodium hydrogen fumarate
	trans-1,2-ethenedicarboxylic acid
	trans-1,2-Ethylenedicarboxylic acid
	trans-Butenedioic acid
	Tumaric acid
	U-1149
	USAF EK-P-583
	(E)-2-Butenedioate
	2-(E)-Butenedioate
	2-(E)-Butenedioic acid
	Allomaleate
	Boletate
	Lichenate
	trans-1,2-Ethylenedicarboxylate
	trans-2-Butenedioate
	trans-2-Butenedioic acid
	trans-Butenedioate
	(2E)-But-2-enedioate
	(2E)-But-2-enedioic acid
	142-42-7

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PubChem SID	151154
	165922
	170694
	204174
	741990
	3729759
	3754587

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PubChem CID	444972
	6364608
	6364607
	5460307
	6076814
	444266
	6365153

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XLogP	-0.300000
	1.000000

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Molecular Formula	C4H4O4
	C4H2O4-2
	C4H3NaO4
	C4H2Na2O4
	C4H2NaO4-

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ChemIDplus ID	000142427

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Source	ChemIDplus

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LinkUrl	http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=444972

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