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Details of Cholestane, 3beta-hydroxy-, 5alpha- (1TMS)

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Role Analyte
nameCholestane, 3beta-hydroxy-, 5alpha- (1TMS)
MPIMP IDA316010
isotopomerambient
formulaC30H56OSi
molecular mass460.852
monoisotopic mass460.41004
InChIInChI=1S/C30H56OSi/c1-21(2)10-9-11-22(3)26-14-15-27-25-13-12-23-20-24(31-32(6,7)8)16-18-29(23,4)28(25)17-19-30(26,27)5/h21-28H,9-20H2,1-8H3/t22-,23?,24?,25+,26-,27+,28+,29+,30-/m1/s1
InChIKeyHRLPEXVPNOBUDF-WHCWVIOUSA-N
substructure TMS1
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)3,200
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%270111640c-69f9-4786-892e-f992e8f1d22a%27)

Synonyms of Cholestane, 3beta-hydroxy-, 5alpha- (1TMS)

propertyvalue
ChemSpider ID20035630
PubChem CID22211874
synonymB000221
synonymCholestane, 3beta-hydroxy-, 5alpha- (1TMS)
4 synonym(s)

Metabolite mapped to Cholestane, 3beta-hydroxy-, 5alpha- (1TMS)

Reference spectra of Cholestane, 3beta-hydroxy-, 5alpha- (1TMS)

replicaentry datedetectionmethodspecies
36/10/2009 12:42:49 PM VAR5Reference Substance
17/19/2007 11:16:30 AM MDN35Reference Substance
27/19/2007 11:16:30 AM MDN35Reference Substance
3 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.
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