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Details of 5beta-Androstane-3,17-dione

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Role	Metabolite
MPIMP ID	M001288
stereoisomer
isotopomer	ambient
formula	C19H28O2
molecular mass	288.425
monoisotopic mass	288.20893
InChI	InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-16H,3-11H2,1-2H3/t12-,14?,15?,16?,18?,19?/m1/s1
InChIKey	RAJWOBJTTGJROA-BQWQYDDZSA-N
class
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27f7a1522d-e228-4f05-bf28-aa3acf007ffa%27)

Synonyms of 5beta-Androstane-3,17-dione

property	value
CAS	1229-12-5
synonym	5beta-Androstane-3,17-dione
2 synonym(s)

Derivatives of 5beta-Androstane-3,17-dione

analyte	stereoisomer	isotopomer
[440114] 5beta-androstane-3,17-dione [24.143]		ambient
1 analyte(s)

Reference substances of 5beta-Androstane-3,17-dione

reference substance	supplier	supplier code	lot
5beta-Androstane-3,17-dione	Sigma	R194271
1 reference substance(s)

Isotopomers and stereoisomers of 5beta-Androstane-3,17-dione

metabolite	stereoisomer	isotopomer
no hits!

Quantitative 5beta-Androstane-3,17-dione 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 5beta-Androstane-3,17-dione Profile Data

species
no qualitative metabolite profile data available!

compound timestamp information
deposited	at 8/29/2006 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed	at 10/1/2012 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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