RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet ID	RM0134982
RefMet name	Succinic acid
Systematic name	Butanedioic acid
Synonyms	PubChem Synonyms
Exact mass	118.026610 (neutral)	Calculate m/z: (Choose adduct) [M+H]+ [M+H-H2O]+ [M.]+ [M+2H]2+ [M+3H]3+ [M+4H]4+ [M+K]+ [M+2K]2+ [M+2K-H]+ [M+Na]+ [M+2Na]2+ [M+2Na-H]+ [M+Li]+ [M+2Li]2+ [M+NH4]+ [M.CH3]+ [M+Ag]+ [M+H+CH3OH]+ [M+H+CH3CN]+ [M+H+2CH3CN]+ [M+Na+CH3CN]+ [M.NaFormate+H]+ [M.NH4Formate+H]+ [M.TMSi]+ [M.tBuDMSi]+ [M+H-Hexose]+ [M+H-EtnP]+ [M+H-SerP]+ [M-H]- [M-H-H2O]- [M-CH3]- [M-2H]2- [M-3H]3- [M-4H]4- [M+Cl]- [M+OAc]- [M+Na-2H]- [M+K-2H]- [M.Formate]- [M.NaFormate-H]- [M.NH4Formate-H]- [M.F]- [M-H-Ser]- [M.HF2]- M(neutral)    View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
Formula	C4H6O4	View other entries in RefMet with this formula
Molecular descriptors
Molfile	1966 (Download molfile/View MW Metabolite Database details)
InChI	InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)
InChIKey	KDYFGRWQOYBRFD-UHFFFAOYSA-N	View other enantiomers/diastereomers of this metabolite in RefMet
SMILES	C(CC(=O)O)C(=O)O Run Tanimoto similarity search (with similarity coefficient >=0.6)
Chemical/Biochemical Classification
Super Class	Organic acids
Main Class	TCA acids
Sub Class	TCA acids
Distribution of Succinic acid in NMDR studies
Species	Plot Species distribution
Sample source	Plot Sample source(tissue) distribution
Studies	NMDR Studies reporting Succinic acid
External Links
Pubchem CID	1110
LIPID MAPS	LMFA01170043
ChEBI ID	15741
KEGG ID	C00042
HMDB ID	HMDB0000254
Chemspider ID	1078
MetaCyc ID	SUC
Spectral data for Succinic acid standards
BMRB ID(NMR)	View NMR spectra
NP-MRD ID(NMR)	View NMR spectra
MassBank(EU)	View MS spectra
Structural annotation level
Annotation level	1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving Succinic acid

Rxn ID	KEGG Reaction	Enzyme
R00402	Succinate + NAD+ <=> Fumarate + NADH + H+	succinate:NAD+ oxidoreductase
R00405	ATP + Succinate + CoA <=> ADP + Orthophosphate + Succinyl-CoA	Succinate:CoA ligase (ADP-forming)
R00406	Succinyl-CoA + (S)-Malate <=> Succinate + L-Malyl-CoA	succinyl-CoA:(S)-malate CoA-transferase
R00432	GTP + Succinate + CoA <=> GDP + Orthophosphate + Succinyl-CoA	Succinate:CoA ligase (GDP-forming)
R00713	Succinate semialdehyde + NAD+ + H2O <=> Succinate + NADH + H+	succinate-semialdehyde:NAD+ oxidoreductase
R00714	Succinate semialdehyde + NADP+ + H2O <=> Succinate + NADPH + H+	succinate-semialdehyde:NADP+ oxidoreductase
R00727	ITP + Succinate + CoA <=> IDP + Orthophosphate + Succinyl-CoA	Succinate:CoA ligase (IDP-forming)
R02164	Quinone + Succinate <=> Hydroquinone + Fumarate	succinate:quinone oxidoreductase
R10343	Succinyl-CoA + Acetate <=> Acetyl-CoA + Succinate	succinyl-CoA:acetate CoA-transferase
R10660	Fumarate + Coenzyme M + Coenzyme B <=> Succinate + Coenzyme M 7-mercaptoheptanoylthreonine-phosphate heterodisulfide	fumarate CoM:CoB oxidoreductase (succinate forming)

Table of KEGG human pathways containing Succinic acid

Pathway ID	Human Pathway	# of reactions
hsa01100	Metabolic pathways	5
hsa01200	Carbon metabolism	5
hsa00020	Citrate cycle (TCA cycle)	3
hsa00640	Propanoate metabolism	2
hsa00250	Alanine, aspartate and glutamate metabolism	1
hsa00650	Butanoate metabolism	1