Chem
J-GLOBAL ID：200907030295662766   Nikkaji number：J515.475H

N-[(2S)-2-[(5R)-1-[N-(5-Aminopentanoyl)-L-Phe-L-Phe-]-6-oxo-1,7-diazaspiro[4.4]nonan-8-yl]-4-methylpentanoyl]-L-Met-NH2

N-[(2S)-2-[(5R)-1-[N-(5-アミノペンタノイル)-L-Phe-L-Phe-]-6-オキソ-1,7-ジアザスピロ[4.4]ノナン-8-イル]-4-メチルペンタノイル]-L-Met-NH2
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： C41H59N7O6S
Molecular formula furigana： C41-H59-N7-O6-S
Molecular weight： 778.030
InChI： InChI=1S/C41H59N7O6S/c1-27(2)23-30(37(51)45-31(36(43)50)18-22-55-3)34-26-41(40(54)47-34)19-12-21-48(41)39(53)33(25-29-15-8-5-9-16-29)46-38(52)32(24-28-13-6-4-7-14-28)44-35(49)17-10-11-20-42/h4-9,13-16,27,30-34H,10-12,17-26,42H2,1-3H3,(H2,43,50)(H,44,49)(H,45,51)(H,46,52)(H,47,54)/t30-,31-,32-,33-,34?,41+/m0/s1
InChI key： DZWTZVVSCBUTHW-DDFYPMMPSA-N
SMILES： CSCC[C@H](NC(=O)[C@@H](CC(C)C)C1C[C@]2(CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCCN)C(=O)N1)C(=O)N
Systematic name  (3)：
  • N-[(2S)-2-[(5R)-1-[N-(5-アミノペンタノイル)-L-Phe-L-Phe-]-6-オキソ-1,7-ジアザスピロ[4.4]ノナン-8-イル]-4-メチルペンタノイル]-L-Met-NH2
  • (2S)-2-[(5R)-1-[(2S)-2-[(2S)-2-(5-アミノペンタンアミド)-3-フェニルプロパンアミド]-3-フェニルプロパノイル]-6-オキソ-1,7-ジアザスピロ[4.4]ノナン-8-イル]-N-[(1S)-1-カルバモイル-3-(メチルスルファニル)プロピル]-4-メチルペンタンアミド
  • (2S)-2-[(5R)-1-[(2S)-2-[(2S)-2-(5-aminopentanamido)-3-phenylpropanamido]-3-phenylpropanoyl]-6-oxo-1,7-diazaspiro[4.4]nonan-8-yl]-N-[(1S)-1-carbamoyl-3-(methylsulfanyl)propyl]-4-methylpentanamide
Other name (1)：
  • N-[(2S)-2-[(5R)-1-[N-(5-Aminopentanoyl)-L-Phe-L-Phe-]-6-oxo-1,7-diazaspiro[4.4]nonan-8-yl]-4-methylpentanoyl]-L-Met-NH2
Thsaurus map：
Thesaurus Map

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