GOLM METABOLOME DATABASE

- home
- search
- ms analysis
  - library search
  - prediction
- GoBioSpace
- blog
- thanks to
- publications
- imprint
- privacy policy
- contact
- help

The GMD web site use latest HTML5 features! This message indicates backward compatibility problems in GMD's mass spectra, chemical compound structure and metabolite profile visualizations. As your browser does not support the HTML5 <canvas> element, please consider to upgrade to a HTML5 ready web browser, including Microsoft Internet Explorer, Mozilla Firefox, Apple Safari, Google Chrome and Opera, to fully enjoy GMD's functionalities!

Details of Pregn-4-ene-11beta-17alpha-diol-3-20-dione

rotate: click+drag; translate: alt+click+drag; zoom: mousewheel; save: mol

Role	Metabolite
MPIMP ID	M001144
stereoisomer
isotopomer	ambient
formula	C21H30O4
molecular mass	346.461
monoisotopic mass	346.21441
InChI	InChI=1S/C21H30O4/c1-12(22)21(25)9-7-16-15-5-4-13-10-14(23)6-8-19(13,2)18(15)17(24)11-20(16,21)3/h10,15-18,24-25H,4-9,11H2,1-3H3/t15-,16-,17-,18+,19-,20-,21-/m0/s1
InChIKey	LCZBQMKVFQNSJR-UJPCIWJBSA-N
class
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%272a30edde-fab3-4b14-bb2c-5add955fd9ab%27)

Synonyms of Pregn-4-ene-11beta-17alpha-diol-3-20-dione

property	value
BRENDA	11447
ChemSpider ID	83796
PubChem CID	92827
PubChem SID	92297899
synonym	Pregn-4-ene-11beta-17alpha-diol-3-20-dione
5 synonym(s)

Derivatives of Pregn-4-ene-11beta-17alpha-diol-3-20-dione

analyte	stereoisomer	isotopomer
Pregn-4-ene-11beta-17alpha-diol-3-20-dione (2MEOX) (1TMS) MP		ambient
Pregn-4-ene-11beta-17alpha-diol-3-20-dione (2MEOX) (2TMS) MP		ambient
Pregn-4-ene-11beta-17alpha-diol-3-20-dione (2MEOX) (1TMS) BP		ambient
3 analyte(s)

Reference substances of Pregn-4-ene-11beta-17alpha-diol-3-20-dione

reference substance	supplier	supplier code	lot
No Reference substances found!

Isotopomers and stereoisomers of Pregn-4-ene-11beta-17alpha-diol-3-20-dione

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Pregn-4-ene-11beta-17alpha-diol-3-20-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 Pregn-4-ene-11beta-17alpha-diol-3-20-dione 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.

Show all metabolites

Top