Chem
J-GLOBAL ID:200907071963215996   Nikkaji number:J1.686.646F

(3S)-N-[(2R)-2-Hydroxypropyl]-3-[[(2S)-2-[[[(2-naphthyl)acetyl]amino]methyl]-3-(1H-indole-3-yl)propionyl]amino]-7-aminoheptanamide

(3S)-7-アミノ-N-[(2R)-2-ヒドロキシプロピル]-3-[(2S)-2-[(1H-インドール-3-イル)メチル]-3-[2-(ナフタレン-2-イル)アセトアミド]プロパンアミド]ヘプタンアミド
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: C34H43N5O4
Molecular formula furigana: C34-H43-N5-O4
Molecular weight: 585.749
InChI: InChI=1S/C34H43N5O4/c1-23(40)20-37-33(42)19-29(10-6-7-15-35)39-34(43)28(18-27-21-36-31-12-5-4-11-30(27)31)22-38-32(41)17-24-13-14-25-8-2-3-9-26(25)16-24/h2-5,8-9,11-14,16,21,23,28-29,36,40H,6-7,10,15,17-20,22,35H2,1H3,(H,37,42)(H,38,41)(H,39,43)/t23-,28+,29+/m1/s1
InChI key: UUAFVWVYHMAPPQ-MGONOCMRSA-N
SMILES: C[C@@H](O)CNC(=O)C[C@H](CCCCN)NC(=O)[C@H](CNC(=O)Cc1ccc2ccccc2c1)Cc1c[nH]c2ccccc12
Systematic name  (3):
  • (3S)-N-[(2R)-2-ヒドロキシプロピル]-3-[[(2S)-2-[[[(2-ナフチル)アセチル]アミノ]メチル]-3-(1H-インドール-3-イル)プロピオニル]アミノ]-7-アミノヘプタンアミド
  • (3S)-7-アミノ-N-[(2R)-2-ヒドロキシプロピル]-3-[(2S)-2-[(1H-インドール-3-イル)メチル]-3-[2-(ナフタレン-2-イル)アセトアミド]プロパンアミド]ヘプタンアミド
  • (3S)-7-amino-N-[(2R)-2-hydroxypropyl]-3-[(2S)-2-[(1H-indol-3-yl)methyl]-3-[2-(naphthalen-2-yl)acetamido]propanamido]heptanamide
Other name (1):
  • (3S)-N-[(2R)-2-Hydroxypropyl]-3-[[(2S)-2-[[[(2-naphthyl)acetyl]amino]methyl]-3-(1H-indole-3-yl)propionyl]amino]-7-aminoheptanamide
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