Chem
J-GLOBAL ID：200907053524677314   Nikkaji number：J734.310H

1-Bromo-5,6,8-trimethyl-8aβ-hydroxy-5,5aα,5bβ,6,8,8a,9,9aα-octahydro-5,6,8,9b-tetraaza-9bH-cyclopent[b]-as-indacene-4,7-dione

1-ブロモ-5,6,8-トリメチル-8aβ-ヒドロキシ-5,5aα,5bβ,6,8,8a,9,9aα-オクタヒドロ-5,6,8,9b-テトラアザ-9bH-シクロペンタ[b]-as-インダセン-4,7-ジオン
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： C14H17BrN4O3
Molecular formula furigana： C14-H17-BR-N4-O3
Molecular weight： 369.219
InChI： InChI=1S/C14H17BrN4O3/c1-16-10-8(19-7(12(16)20)4-5-9(19)15)6-14(22)11(10)17(2)13(21)18(14)3/h4-5,8,10-11,22H,6H2,1-3H3/t8-,10-,11+,14+/m1/s1
InChI key： BJRPQHYXIKTFQN-GJTWSCIVSA-N
SMILES： CN1[C@H]2[C@H]3[C@@H](C[C@@]2(O)N(C)C1=O)n1c(Br)ccc1C(=O)N3C
Systematic name  (3)：
  • 1-ブロモ-5,6,8-トリメチル-8aβ-ヒドロキシ-5,5aα,5bβ,6,8,8a,9,9aα-オクタヒドロ-5,6,8,9b-テトラアザ-9bH-シクロペンタ[b]-as-インダセン-4,7-ジオン
  • (1R,9R,10S,14S)-3-ブロモ-14-ヒドロキシ-8,11,13-トリメチル-2,8,11,13-テトラアザテトラシクロ[7.6.0.02,6.010,14]ペンタデカ-3,5-ジエン-7,12-ジオン
  • (1R,9R,10S,14S)-3-bromo-14-hydroxy-8,11,13-trimethyl-2,8,11,13-tetraazatetracyclo[7.6.0.02,6.010,14]pentadeca-3,5-diene-7,12-dione
Other name (1)：
  • 1-Bromo-5,6,8-trimethyl-8aβ-hydroxy-5,5aα,5bβ,6,8,8a,9,9aα-octahydro-5,6,8,9b-tetraaza-9bH-cyclopent[b]-as-indacene-4,7-dione
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