Chem
J-GLOBAL ID：200907086673639382   Nikkaji number：J867.350K

(3R)-3β-Hydroxy-3-benzyl-1-methyl-6α-(4-nitro-1H-indol-3-ylmethyl)-2,5-piperazinedione

(3R)-3β-ヒドロキシ-3-ベンジル-1-メチル-6α-(4-ニトロ-1H-インドール-3-イルメチル)-2,5-ピペラジンジオン
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： C21H20N3[N+]O4[O-]
Molecular formula furigana： C21-H20-N4-O5
Molecular weight： 408.414
InChI： InChI=1S/C21H20N4O5/c1-24-17(10-14-12-22-15-8-5-9-16(18(14)15)25(29)30)19(26)23-21(28,20(24)27)11-13-6-3-2-4-7-13/h2-9,12,17,22,28H,10-11H2,1H3,(H,23,26)/t17-,21+/m0/s1
InChI key： CRDXCBHAFGPWRN-LAUBAEHRSA-N
SMILES： CN1[C@@H](Cc2c[nH]c3cccc([N+](=O)[O-])c23)C(=O)N[C@@](O)(Cc2ccccc2)C1=O
Systematic name  (3)：
  • (3R)-3β-ヒドロキシ-3-ベンジル-1-メチル-6α-(4-ニトロ-1H-インドール-3-イルメチル)-2,5-ピペラジンジオン
  • (3R,6S)-3-ベンジル-3-ヒドロキシ-1-メチル-6-[(4-ニトロ-1H-インドール-3-イル)メチル]ピペラジン-2,5-ジオン
  • (3R,6S)-3-benzyl-3-hydroxy-1-methyl-6-[(4-nitro-1H-indol-3-yl)methyl]piperazine-2,5-dione
Other name (1)：
  • (3R)-3β-Hydroxy-3-benzyl-1-methyl-6α-(4-nitro-1H-indol-3-ylmethyl)-2,5-piperazinedione
Thsaurus map：
Thesaurus Map

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