6ß-Hydroxytestosterone

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Systematic / IUPAC Name: (6R,8R,9S,10R,13S,14S,17S)-6,17-dihydroxy-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one

ID: Reference273

Other Names: 6β-Hydroxytestosterone;
6β,17β-Dihydroxyandrost-4-en-3-one;
6β,17β-Dihydroxy-4-androsten-3-one;
(6β,17β)-6,17-Dihydroxyandrost-4-en-3-one;
6,17-Dihydroxy-(6β,17β)-androst-4-en-3-one

Formula: C19H28O3

Class: Endogenous Metabolites

Spectral Data

6ß-Hydroxytestosterone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 174
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods ESI
Analyzers FT
Last Modification 12/4/2014 2:31:12 PM
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Identificators

InChI InChI=1S/C19H28O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h9,12-14,16-17,21-22H,3-8,10H2,1-2H3/t12-,13-,14-,16+,17-,18+,19-/m0/s1
InChI Key XSEGWEUVSZRCBC-ZVBLRVHNSA-N
Canonical SMILES O=C4\C=C3/C(C2CCC1(C(CCC1O)C2CC3O)C)(C)CC4
CAS 62997
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Other Names 6β-Hydroxytestosterone;
6β,17β-Dihydroxyandrost-4-en-3-one;
6β,17β-Dihydroxy-4-androsten-3-one;
(6β,17β)-6,17-Dihydroxyandrost-4-en-3-one;
6,17-Dihydroxy-(6β,17β)-androst-4-en-3-one;
4-Androsten-6β,17β-diol-3-one

In Other Databases

ChEBI CHEBI:34477
ChEMBL CHEMBL2074878
ChemIDPlus 000062997
HMDb HMDB06259
PubChem 65543
ChemSpider 58987
KEGG C14497