6 β-Hydroxycortisol

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Systematic / IUPAC Name: (6β,11β)-6,11,17,21-Tetrahydroxypregn-4-ene-3,20-dione

ID: Reference1854

Other Names: (6R,8S,9S,10R,11S,13S,14S,17R)-6,11,17-Trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one;
6β,11β,17α,21-Tetrahydroxypregn-4-en-3,20-dione;
6β,17-Dihydroxycorticosterone;
Corticosterone, 6β,17-dihydroxy-;
Pregn-4-en-3,20-dione, 6,11,17,21-tetrahydroxy-, (6β,11β)-

Formula: C21H30O6

Class: Endogenous Metabolites

Spectral Data

6 β-Hydroxycortisol 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; Q Exactive Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 5020
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI; NSI
Analyzers IT; FT
Last Modification 12/15/2016 11:49:32 AM
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Identificators

InChI InChI=1S/C21H30O6/c1-19-5-3-11(23)7-14(19)15(24)8-12-13-4-6-21(27,17(26)10-22)20(13,2)9-16(25)18(12)19/h7,12-13,15-16,18,22,24-25,27H,3-6,8-10H2,1-2H3/t12-,13-,15+,16-,18+,19-,20-,21-/m0/s1
InChI Key GNFTWPCIRXSCQF-UJXAPRPESA-N
Canonical SMILES CC12CCC(=O)C=C1C(CC3C2C(CC4(C3CCC4(C(=O)CO)O)C)O)O
CAS
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Other Names (6R,8S,9S,10R,11S,13S,14S,17R)-6,11,17-Trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one;
6β,11β,17α,21-Tetrahydroxypregn-4-en-3,20-dione;
6β,17-Dihydroxycorticosterone;
Corticosterone, 6β,17-dihydroxy-;
Pregn-4-en-3,20-dione, 6,11,17,21-tetrahydroxy-, (6β,11β)-;
Pregn-4-ene-3,20-dione, 6β,11β,17,21-tetrahydroxy-

In Other Databases

ChemSpider 5254712
PubChem 6852390
ChEMBL CHEMBL1389133