Chem
J-GLOBAL ID：200907065072452377   Nikkaji number：J213.750J

VBP15

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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： C22H28O4
Molecular formula furigana： C22-H28-O4
Molecular weight： 356.462
InChI： InChI=1S/C22H28O4/c1-13-10-18-16-5-4-14-11-15(24)6-8-20(14,2)17(16)7-9-21(18,3)22(13,26)19(25)12-23/h6-8,11,13,16,18,23,26H,4-5,9-10,12H2,1-3H3/t13-,16-,18+,20+,21+,22+/m1/s1
InChI key： ZYTXTXAMMDTYDQ-DGEXFFLYSA-N
SMILES： C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)C3=CC[C@]2(C)[C@@]1(O)C(=O)CO
Systematic name  (5)：
  • 17,21-ジヒドロキシ-16α-メチルプレグナ-1,4,9(11)-トリエン-3,20-ジオン
  • 3-オキソ-16α-メチル-17-ヒドロキシ-17β-(2-ヒドロキシアセチル)アンドロスタ-1,4,9(11)-トリエン
  • 16α-メチル-17,21-ジヒドロキシプレグナ-1,4,9(11)-トリエン-3,20-ジオン
  • (1R,2R,3aS,3bS,9aS,11aS)-1-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,11H,11aH-シクロペンタ[a]フェナントレン-7-オン
  • (1R,2R,3aS,3bS,9aS,11aS)-1-hydroxy-1-(2-hydroxyacetyl)-2,9a,11a-trimethyl-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,11H,11aH-cyclopenta[a]phenanthren-7-one
Other name (7)：
  • 17,21-Dihydroxy-16α-methylpregna-1,4,9(11)-triene-3,20-dione
  • 3-Oxo-16α-methyl-17-hydroxy-17β-(2-hydroxyacetyl)androsta-1,4,9(11)-triene
  • 16α-Methyl-17,21-dihydroxypregna-1,4,9(11)-triene-3,20-dione
  • VBP-15
  • Vamorolone
Show all
CAS registry number： 13209-41-1
Regulation number (1)：
  • EINECS2361778
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