Chem
J-GLOBAL ID:200907049212774587   Nikkaji number:J439.776B

N2-[(2R,3R)-3-Amino-2-hydroxy-4-[2-[(2-nitrophenyl)thio]-1H-indol-3-yl]butyryl]-L-lysine

N2-[(2R,3R)-3-アミノ-2-ヒドロキシ-4-[2-[(2-ニトロフェニル)チオ]-1H-インドール-3-イル]ブチリル]-L-リシン
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: C24H29N4[N+]O5[O-]S
Molecular formula furigana: C24-H29-N5-O6-S
Molecular weight: 515.590
InChI: InChI=1S/C24H29N5O6S/c25-12-6-5-9-18(24(32)33)27-22(31)21(30)16(26)13-15-14-7-1-2-8-17(14)28-23(15)36-20-11-4-3-10-19(20)29(34)35/h1-4,7-8,10-11,16,18,21,28,30H,5-6,9,12-13,25-26H2,(H,27,31)(H,32,33)/t16-,18+,21-/m1/s1
InChI key: UASACHUOOFAUSO-PLMTUMEDSA-N
SMILES: NCCCC[C@H](NC(=O)[C@H](O)[C@H](N)Cc1c(Sc2ccccc2[N+](=O)[O-])[nH]c2ccccc12)C(=O)O
Systematic name  (3):
  • N2-[(2R,3R)-3-アミノ-2-ヒドロキシ-4-[2-[(2-ニトロフェニル)チオ]-1H-インドール-3-イル]ブチリル]-L-リシン
  • (2S)-6-アミノ-2-[(2R,3R)-3-アミノ-2-ヒドロキシ-4-{2-[(2-ニトロフェニル)スルファニル]-1H-インドール-3-イル}ブタンアミド]ヘキサン酸
  • (2S)-6-amino-2-[(2R,3R)-3-amino-2-hydroxy-4-{2-[(2-nitrophenyl)sulfanyl]-1H-indol-3-yl}butanamido]hexanoic acid
Other name (1):
  • N2-[(2R,3R)-3-Amino-2-hydroxy-4-[2-[(2-nitrophenyl)thio]-1H-indol-3-yl]butyryl]-L-lysine
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