Chem
J-GLOBAL ID:200907072762094623
Nikkaji number:J14.680C
Halometasone
ハロメタソン
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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:
C22 H27 ClF2 O5
Molecular formula furigana:
C22-H27-CL-F2-O5
Molecular weight:
444.900
InChI:
InChI=1S/C22H27ClF2O5/c1-10-4-11-12-5-15(24)13-6-16(27)14(23)7-19(13,2)21(12,25)17(28)8-20(11,3)22(10,30)18(29)9-26/h6-7,10-12,15,17,26,28,30H,4-5,8-9H2,1-3H3/t10-,11+,12+,15+,17+,19+,20+,21+,22+/m1/s1
InChI key:
GGXMRPUKBWXVHE-MIHLVHIWSA-N
SMILES:
C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C(=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO)Cl
Systematic name (3):
2-クロロ-6α,9-ジフルオロ-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,5S,9aS,9bR,10S,11aS)-8-クロロ-5,9b-ジフルオロ-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,5S,9aS,9bR,10S,11aS)-8-chloro-5,9b-difluoro-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 (4):
ハロメタソン
ハロメタゾン
Halometasone
2-Chloro-6α,9-difluoro-11β,17,21-trihydroxy-16α-methylpregna-1,4-diene-3,20-dione
CAS registry number:
50629-82-8
Regulation number (1):
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