Chem
J-GLOBAL ID:200907048349981478   Nikkaji number:J271.703D

O-Methyl-L-Tyr-Gly-N-diazoacetyl Gly-L-Phe-L-Leu-L-Arg-L-Arg-D-Leu-NH2

O-メチル-L-Tyr-Gly-N-ジアゾアセチルGly-L-Phe-L-Leu-L-Arg-L-Arg-D-Leu-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: C49H75N15[N-][N+]O10
Molecular formula furigana: C49-H75-N17-O10
Molecular weight: 1062.248
InChI: InChI=1S/C49H75N17O10/c1-27(2)21-35(41(51)69)64-44(72)34(14-10-20-58-49(54)55)62-43(71)33(13-9-19-57-48(52)53)63-45(73)36(22-28(3)4)65-46(74)37(24-29-11-7-6-8-12-29)61-39(68)26-60-47(75)40(66-56)38(67)25-59-42(70)32(50)23-30-15-17-31(76-5)18-16-30/h6-8,11-12,15-18,27-28,32-37H,9-10,13-14,19-26,50H2,1-5H3,(H2,51,69)(H,59,70)(H,60,75)(H,61,68)(H,62,71)(H,63,73)(H,64,72)(H,65,74)(H4,52,53,57)(H4,54,55,58)/t32-,33-,34-,35+,36-,37-/m0/s1
InChI key: XZSNVPUYOCVQKV-AWWLJPPNSA-N
SMILES: COc1ccc(C[C@H](N)C(=O)NCC(=O)C(=[N+]=[N-])C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CC(C)C)C(=O)N)cc1
Systematic name  (3):
  • O-メチル-L-Tyr-Gly-N-ジアゾアセチルGly-L-Phe-L-Leu-L-Arg-L-Arg-D-Leu-NH2
  • (2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-(2-{4-[(2S)-2-アミノ-3-(4-メトキシフェニル)プロパンアミド]-2-ジアゾ-3-オキソブタンアミド}アセトアミド)-3-フェニルプロパンアミド]-4-メチルペンタンアミド]-5-カルバムイミドアミドペンタンアミド]-5-カルバムイミドアミドペンタンアミド]-4-メチルペンタンアミド
  • (2R)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-(2-{4-[(2S)-2-amino-3-(4-methoxyphenyl)propanamido]-2-diazo-3-oxobutanamido}acetamido)-3-phenylpropanamido]-4-methylpentanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-4-methylpentanamide
Other name (1):
  • O-Methyl-L-Tyr-Gly-N-diazoacetyl Gly-L-Phe-L-Leu-L-Arg-L-Arg-D-Leu-NH2
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