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Details of Pregnane-3,20-dione, 5beta- (2MEOX) MP

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Role Analyte
namePregnane-3,20-dione, 5beta- (2MEOX) MP
MPIMP IDA290014
isotopomerambient
formulaC23H38N2O2
molecular mass374.561
monoisotopic mass374.29333
InChIInChI=1S/C23H38N2O2/c1-15(24-26-4)19-8-9-20-18-7-6-16-14-17(25-27-5)10-12-22(16,2)21(18)11-13-23(19,20)3/h16,18-21H,6-14H2,1-5H3/b24-15+,25-17+/t16-,18+,19-,20+,21+,22+,23-/m1/s1
InChIKeyBRBZYVRSVCPKEU-SFLWZWBMSA-N
substructure TMS 
substructure TBS0
substructure H3ON 
substructure CH3O 
retention index (VAR5 method, n-alkanes C10–C36)2,901.63
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%2710760a21-7340-4d0b-a023-9b1f7060485e%27)

Synonyms of Pregnane-3,20-dione, 5beta- (2MEOX) MP

propertyvalue
ChemSpider ID20160823
synonymB000029
synonymPregnane-3,20-dione, 5beta- (2MEOX) MP
3 synonym(s)

Metabolite mapped to Pregnane-3,20-dione, 5beta- (2MEOX) MP

Reference spectra of Pregnane-3,20-dione, 5beta- (2MEOX) MP

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM MDN35Reference Substance
27/19/2007 11:16:30 AM VAR5Reference Substance
2 spectrum(a)
compound timestamp information
deposited at 7/16/2007 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed at 8/11/2011 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Hummel J.
service last updated 17/02/2017 © 2008-2014 Golm Metabolome Database - All rights reserved
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