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11,17-Dihydroxy-3,20-dioxopregna-1,4-dien-21-yl acetate

View entire compound with spectra: 1 NMR, and 2 MS (GC)

11,17-Dihydroxy-3,20-dioxopregna-1,4-dien-21-yl acetate
SpectraBase Compound ID AT5VVGNhHNi
InChI InChI=1S/C23H30O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h6,8,10,16-18,20,26,28H,4-5,7,9,11-12H2,1-3H3
InChIKey LRJOMUJRLNCICJ-UHFFFAOYSA-N
Mol Weight 402.49 g/mol
Molecular Formula C23H30O6
Exact Mass 402.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JYcULanwEGO
Name 11,17-Dihydroxy-3,20-dioxopregna-1,4-dien-21-yl acetate
Alternate Name(s) (11.beta.)-21-(Acetyloxy)-11,17-dihydroxypregna-1,4-diene-3,20-dione 11beta,17,21-trihydroxypregna-1,4-diene-3,20-dione 21-acetate Ak-Tate Blephamide liquifilm Blephamide s.o.p. Cetapred ointment Component of Composone Component of Isopto cetapred Component of Metimyd Cormalone Cortipred Delcort-E Deltilen Durapred Econopred Inflanefran Meticortelone acetate Meticotelone acetate Mydrapred Nisolone Pred Forte Pred Forte TM Pred Mild Pred-g liquifilm PRED-G S.O.P. Predalone 50 Prediacortine Predicort Prednelan-N Prednidoren Prednisolone Acetate Prednisolone-21-acetate Predonine injection Pregna-1,4-diene-3,20-dione, 11-beta,17,21-trihydroxy-, 21-acetate Pregna-1,4-diene-3,20-dione, 11.beta.,17,21-trihydroxy-, 21-acetate Pregna-1,4-diene-3,20-dione, 21-(acetyloxy)-11,17-dihydroxy-, (11beta)- Prenema Pricortin Sterane Sterane im and IA Supercortyl Vasocidin ointment Acetic acid [2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] ester [2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate [2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxo-ethyl] acetate [2-[10,13-dimethyl-11,17-bis(oxidanyl)-3-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethyl] ethanoate BRN 3111798 EINECS 200-134-1 NSC 10966
CAS Registry Number 52-21-1
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Formula C23H30O6
InChI InChI=1S/C23H30O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h6,8,10,16-18,20,26,28H,4-5,7,9,11-12H2,1-3H3
InChIKey LRJOMUJRLNCICJ-UHFFFAOYSA-N
Molecular Weight 402.487 g/mol
SMILES OC1CC2(C(CCC2(C(COC(C)=O)=O)O)C2C1C1(C(CC2)=CC(C=C1)=O)C)C
SPLASH splash10-006x-7930000000-e33e8d43a4105d5c50d7
Source of Spectrum PG-1982-261-0
Wiley ID 1370414