Chem
J-GLOBAL ID：200907022357230024   Nikkaji number：J10.295D

RS-2362

プロシノニド
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C27H34F2O7
Molecular formula furigana： C27-H34-F2-O7
Molecular weight： 508.559
InChI： InChI=1S/C27H34F2O7/c1-6-22(33)34-13-20(32)27-21(35-23(2,3)36-27)11-15-16-10-18(28)17-9-14(30)7-8-24(17,4)26(16,29)19(31)12-25(15,27)5/h7-9,15-16,18-19,21,31H,6,10-13H2,1-5H3/t15-,16-,18-,19-,21+,24-,25-,26-,27+/m0/s1
InChI key： UBOIMZIXNXGQOH-RTWVSBIPSA-N
SMILES： CCC(=O)OCC(=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]1[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]21C
Systematic name  (3)：
  • 6α,9-ジフルオロ-11β-ヒドロキシ-16α,17-[(1-メチルエチリデン)ビス(オキシ)]-21-(1-オキソプロポキシ)プレグナ-1,4-ジエン-3,20-ジオン
  • 2-[(1S,2S,4R,8S,9S,11S,12R,13S,19S)-12,19-ジフルオロ-11-ヒドロキシ-6,6,9,13-テトラメチル-16-オキソ-5,7-ジオキサペンタシクロ[10.8.0.02,9.04,8.013,18]イコサ-14,17-ジエン-8-イル]-2-オキソエチル プロパノアート
  • 2-[(1S,2S,4R,8S,9S,11S,12R,13S,19S)-12,19-difluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl propanoate
Other name (4)：
  • プロシノニド
  • RS-2362
  • Procinonide
  • 6α,9-Difluoro-11β-hydroxy-16α,17-[(1-methylethylidene)bis(oxy)]-21-(1-oxopropoxy)pregna-1,4-diene-3,20-dione
CAS registry number： 58497-00-0
Regulation number (1)：
  • EINECS2612899
KEGG DRUG： D05616
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