Chem
J-GLOBAL ID:200907027445995628   Nikkaji number:J585.364H

Nα-[N-[(R)-1-Carboxy-3-[(1,3-dihydro-1,3-dioxo-2H-benz[f]isoindol)-2-yl]propyl]-L-leucyl]-N-(2-morpholinoethyl)-L-leucinamide

Nα-[N-[(R)-1-カルボキシ-3-[(1,3-ジヒドロ-1,3-ジオキソ-2H-ベンゾ[f]イソインドール)-2-イル]プロピル]-L-ロイシル]-N-(2-モルホリノエチル)-L-ロイシンアミド
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: C34H47N5O7
Molecular formula furigana: C34-H47-N5-O7
Molecular weight: 637.778
InChI: InChI=1S/C34H47N5O7/c1-21(2)17-28(30(40)35-10-12-38-13-15-46-16-14-38)37-31(41)29(18-22(3)4)36-27(34(44)45)9-11-39-32(42)25-19-23-7-5-6-8-24(23)20-26(25)33(39)43/h5-8,19-22,27-29,36H,9-18H2,1-4H3,(H,35,40)(H,37,41)(H,44,45)/t27-,28+,29+/m1/s1
InChI key: OVKVSVACJPYFHM-ULNSLHSMSA-N
SMILES: CC(C)C[C@H](N[C@H](CCN1C(=O)c2cc3ccccc3cc2C1=O)C(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)NCCN1CCOCC1
Systematic name  (3):
  • Nα-[N-[(R)-1-カルボキシ-3-[(1,3-ジヒドロ-1,3-ジオキソ-2H-ベンゾ[f]イソインドール)-2-イル]プロピル]-L-ロイシル]-N-(2-モルホリノエチル)-L-ロイシンアミド
  • (2R)-4-{1,3-ジオキソ-1H,2H,3H-ベンゾ[f]イソインドール-2-イル}-2-{[(1S)-3-メチル-1-{[(1S)-3-メチル-1-{[2-(モルホリン-4-イル)エチル]カルバモイル}ブチル]カルバモイル}ブチル]アミノ}ブタン酸
  • (2R)-4-{1,3-dioxo-1H,2H,3H-benzo[f]isoindol-2-yl}-2-{[(1S)-3-methyl-1-{[(1S)-3-methyl-1-{[2-(morpholin-4-yl)ethyl]carbamoyl}butyl]carbamoyl}butyl]amino}butanoic acid
Other name (1):
  • Nα-[N-[(R)-1-Carboxy-3-[(1,3-dihydro-1,3-dioxo-2H-benz[f]isoindol)-2-yl]propyl]-L-leucyl]-N-(2-morpholinoethyl)-L-leucinamide
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