Chem
J-GLOBAL ID:200907081365391653   Nikkaji number:J18.598A

Alclometasone

アルクロメタソン
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: C22H29ClO5
Molecular formula furigana: C22-H29-CL-O5
Molecular weight: 408.920
InChI: InChI=1S/C22H29ClO5/c1-11-6-14-18-15(23)8-12-7-13(25)4-5-20(12,2)19(18)16(26)9-21(14,3)22(11,28)17(27)10-24/h4-5,7,11,14-16,18-19,24,26,28H,6,8-10H2,1-3H3/t11-,14+,15-,16+,18-,19+,20+,21+,22+/m1/s1
InChI key: FJXOGVLKCZQRDN-PHCHRAKRSA-N
SMILES: C[C@@H]1C[C@H]2[C@@H]3[C@H](Cl)CC4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO
Systematic name  (3):
  • 7α-クロロ-11β,17,21-トリヒドロキシ-16α-メチルプレグナ-1,4-ジエン-3,20-ジオン
  • (1R,2R,3aS,3bS,4R,9aR,9bS,10S,11aS)-4-クロロ-1,10-ジヒドロキシ-1-(2-ヒドロキシアセチル)-2,9a,11a-トリメチル-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-オン
  • (1R,2R,3aS,3bS,4R,9aR,9bS,10S,11aS)-4-chloro-1,10-dihydroxy-1-(2-hydroxyacetyl)-2,9a,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-one
Other name (3):
  • アルクロメタソン
  • Alclometasone
  • 7α-Chloro-11β,17,21-trihydroxy-16α-methylpregna-1,4-diene-3,20-dione
CAS registry number: 67452-97-5
KEGG DRUG: D07116
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