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Deflazacort
SpectraBase Compound ID KyBXpgpZKDC
InChI InChI=1S/C25H31NO6/c1-13-26-25(20(30)12-31-14(2)27)21(32-13)10-18-17-6-5-15-9-16(28)7-8-23(15,3)22(17)19(29)11-24(18,25)4/h7-9,17-19,21-22,29H,5-6,10-12H2,1-4H3/t17-,18-,19-,21+,22+,23-,24-,25+/m0/s1
InChIKey FBHSPRKOSMHSIF-GRMWVWQJSA-N
Mol Weight 441.52 g/mol
Molecular Formula C25H31NO6
Exact Mass 441.215138 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LFp5Ln78KzV
Name Deflazacort
Source of Sample Sigma-Aldrich Company LLC
Catalog Number SML0123
Lot Number 081M4724V
CAS Registry Number 14484-47-0
Classification anti-inflammatory and immunosuppressant glucocorticoid
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H31NO6
InChI InChI=1S/C25H31NO6/c1-13-26-25(20(30)12-31-14(2)27)21(32-13)10-18-17-6-5-15-9-16(28)7-8-23(15,3)22(17)19(29)11-24(18,25)4/h7-9,17-19,21-22,29H,5-6,10-12H2,1-4H3/t17-,18-,19-,21+,22+,23-,24-,25+/m0/s1
InChIKey FBHSPRKOSMHSIF-GRMWVWQJSA-N
Instrument Name Bio-Rad FTS
SMILES O[C@]1(C[C@@]2([C@@]3(\N=C/(O[C@@]3(C[C@]2([C@@]2(CC\C3=C\C(\C=C/[C@@]3([C@@]12[H])C)=O)[H])[H])[H])C)C(COC(=O)C)=O)C)[H]
Source of Spectrum Forensic Spectral Research
Synonyms (11β,16β)-21-(Acetyloxy)-11-hydroxy-2′-methyl-5′H-pregna-1,4-dieno[17,16-d]oxazole-3,20-dione; 11β,21-dihydroxy-2′-methyl-5′βH-pregna-1,4-dieno[17,16-d]oxazole-3,20-dione 2′-acetate, azacort, oxazacort, pregna-1,4-diene-11β,21-diol-3,20-dione[17α,16α-d]-2′-methyloxazoline 21-acetate
Technique KBr0