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Pregn-4-ene-3,20-dione, 17,21-dihydroxy-

View entire compound with spectra: 3 MS (GC)

Pregn-4-ene-3,20-dione, 17,21-dihydroxy-
SpectraBase Compound ID 8i4eYjz081j
InChI InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3/t15?,16?,17?,19?,20?,21-/m0/s1
InChIKey WHBHBVVOGNECLV-VLAJLFEZSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6AVoMfvU0Z5
Name Pregn-4-ene-3,20-dione, 17,21-dihydroxy-
Alternate Name(s) (17R)-10,13-dimethyl-17-oxidanyl-17-(2-oxidanylethanoyl)-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one (17R)-17-glycoloyl-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one (17R)-17-hydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one (17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one 11-Deoxy-17-hydroxycorticosterone 11-Deoxycortisol 11-Deoxyhydrocortisone 11-Desoxy-17-hydroxycorticosterone 11-Desoxycortisol 11-Desoxyhydrocortisone 11-Dioxycortisol 17,21-Dihydroxy-4-pregnene-3,20-dione 17,21-Dihydroxypregn-4-ene-3,20-dione 17,21-Dihydroxyprogesterone 17-(1-keto-2-hydroxyethyl)-4-androsten-17alpha, 21-ol-3-one 17-Hydroxy-11-deoxycorticosterone 17-Hydroxydesoxycorticosterone 17.alpha.-Hydroxycortexone 4-Pregnene-17alpha,21-diol-3,20-dione Cortexolone Corticosterone, 11-deoxy-17-hydroxy- Cortisol, 11-deoxy- Cortisol, 11-dioxy- Cortodoxona Cortodoxone Cortodoxonum Reichstein S Reichstein's Compound S Reichstein's substance S Substance S BRN 2511358 EINECS 205-805-2 SK&F 3050 SKF 3050
CAS Registry Number 152-58-9
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Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3/t15?,16?,17?,19?,20?,21-/m0/s1
InChIKey WHBHBVVOGNECLV-VLAJLFEZSA-N
Molecular Weight 346.467 g/mol
SMILES OCC([C@@]1(C2(C(C3CCC=4C(C3CC2)(CCC(=O)C4)C)CC1)C)O)=O
SPLASH splash10-002o-9871000000-aa5ea6412c30c857c0ce
Source of Spectrum EP-1403-0-0
Wiley ID 1339459