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Details of Chenodeoxycholic acid

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Role	Metabolite
MPIMP ID	M001159
stereoisomer
isotopomer	ambient
formula	C24H40O4
molecular mass	392.573
monoisotopic mass	392.29266
InChI	InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1
InChIKey	RUDATBOHQWOJDD-BSWAIDMHSA-N
class
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%270dbbbc66-0cfa-4db9-97f4-5b1492756a02%27)

Synonyms of Chenodeoxycholic acid

property	value
BRENDA	13143
ChEBI ID	ChEBI:16755
ChEBI ontology	is a bile acid
ChEBI ontology	is a dihydroxy-5beta-cholanic acid
ChEBI ontology	is conjugate acid of chenodeoxycholate
ChemSpider ID	9728
PubChem CID	10133
PubChem SID	92297901
synonym	3alpha,7alpha-dihydroxy-5beta-cholan-24-oic acid
synonym	3alpha,7alpha-Dihydroxy-5beta-cholanic acid
19 synonym(s)
Page of 2 Results per page:

Derivatives of Chenodeoxycholic acid

analyte	stereoisomer	isotopomer
Chenodeoxycholic acid (3TMS)		ambient
1 analyte(s)

Reference substances of Chenodeoxycholic acid

reference substance	supplier	supplier code	lot
Chenodeoxycholic acid sodium salt	Sigma	C8261	121K1118
1 reference substance(s)

Isotopomers and stereoisomers of Chenodeoxycholic acid

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Chenodeoxycholic acid 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	Heatmap	Box plot	Variance	Anova F score
no metabolite profile(s) found.

Qualitative Chenodeoxycholic acid Profile Data

species
no qualitative metabolite profile data available!

compound timestamp information
deposited	at 4/17/2009 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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