Details of Glutaric acid, 3-hydroxy-3-methyl-

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Role	Metabolite
MPIMP ID	M000961
stereoisomer
isotopomer	ambient
formula	C6H10O5
molecular mass	162.141
monoisotopic mass	162.05283
InChI	InChI=1S/C6H10O5/c1-6(11,2-4(7)8)3-5(9)10/h11H,2-3H2,1H3,(H,7,8)(H,9,10)
InChIKey	NPOAOTPXWNWTSH-UHFFFAOYSA-N
class
application/atom+xml	http://gmd-dev.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27a90fc159-16ed-49ca-9a7f-d90b0a5b3ebc%27)

Synonyms of Glutaric acid, 3-hydroxy-3-methyl-

property	value
BRENDA	21775
CAS	503-49-1
ChEBI ID	ChEBI:16831
ChEBI ontology	has functional parent glutaric acid
ChEBI ontology	is a 3-hydroxy carboxylic acid
ChEBI ontology	is a dicarboxylic acid
ChEBI ontology	is a tertiary alcohol
ChEBI ontology	is conjugate acid of 3-hydroxy-3-methylglutarate(1-)
ChemSpider ID	1600
PubChem CID	1662
24 synonym(s)
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Derivatives of Glutaric acid, 3-hydroxy-3-methyl-

analyte	stereoisomer	isotopomer
Glutaric acid, 3-hydroxy-3-methyl- (3TMS)		ambient
3-HYDROXY-3-METHYLGLUTARATE, TBS 3X		ambient
3-HYDROXY-3METHYLGLUTARATE, TBS 2X		ambient
3 analyte(s)

Reference substances of Glutaric acid, 3-hydroxy-3-methyl-

reference substance	supplier	supplier code	lot
Glutaric acid, 3-hydroxy-3-methyl-	Sigma	H4392
Glutaric acid, 3-hydroxy-3-methyl-	Fluka	55695	225449 787
Glutaric acid, 3-hydroxy-3-methyl-	Fluka	55695	225449/1 697
3 reference substance(s)

Isotopomers and stereoisomers of Glutaric acid, 3-hydroxy-3-methyl-

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Glutaric acid, 3-hydroxy-3-methyl- Profile Data

Each graph visualises metabolite concentrations across a single metabolite profiling experiment. Each box plot represents relative (normalised) metabolite concentrations for single replica groups in the specific metabolite profiling experiment.

Name	Organism	Factor	Variance	Anova F score
Mining for metabolic responses to long-term salt stress: a case study on the model legume Lotus japonicus (C)	Lotus	Salt	526.26	83.49
Mining for metabolic responses to long-term salt stress: a case study on the model legume Lotus japonicus (A)	Lotus	Salt	385.77	43.54
Metabolomic responses to long-term salt stress in related Lotus species (A)	Lotus	Germplasm, Salt	486.99	38.39
metabolic changes during developmental senescence: a case study on Arabidopsis thaliana (single leaves)	Arabidopsis	Material, Time, Total Light	957.83	30.76
Metabolomic responses to long-term salt stress in related Lotus species (B)	Lotus	Germplasm, Salt	554.33	21.92
Metabolomic profiles in short day, after bolting, single leaf analysis, Arabidopsis thaliana	Arabidopsis	LeafPosition, Material	298.43	9.32
Metabolomic profiles in long day, after bolting, single leaf analysis, Arabidopsis thaliana	Arabidopsis	LeafPosition, Material	207.60	3.01
Mining for metabolic responses to long-term salt stress: a case study on the model legume Lotus japonicus (B)	Lotus	Salt	205.04	2.97
Metabolomic profiles in short day, before bolting, single leaf analysis, Arabidopsis thaliana	Arabidopsis	LeafPosition, Material	603.89	1.13
Metabolomic profiles long day and before bolting, single leaf analysis, Arabidopsis thaliana	Arabidopsis	LeafPosition, Material	368.95	0.30
10 quantitative metabolite profile(s)

Qualitative Glutaric acid, 3-hydroxy-3-methyl- Profile Data

species
Arabidopsis thaliana.Col-0
Lotus burtii.B303
Lotus corniculatus.San Gabriel
Lotus creticus
Lotus filicaulis
Lotus Japonicus.Gifu
Lotus japonicus.Gifu B129
Lotus japonicus.MG20
Lotus tenuis.La Esmeralda
Lotus uliginosus.LE G27
this metabolite was recorded in 10 species

compound timestamp information
deposited	at 4/14/2009 by Strehmel N., Max Planck Institute of Molecular Plant Physiology, Department of Molecular Plant Physiology (Prof. Willmitzer L), Am Muehlenberg 1, D-14476 Golm, Germany
last changed	at 5/21/2012 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Strehmel N., Hummel J.

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