Chem
J-GLOBAL ID:200907049407963082   Nikkaji number:J263.986F

N-Methyl-L-Tyr-Gly-Gly-L-Phe-L-Leu-L-Arg-L-Arg-D-Leu-OH

N-メチル-L-Tyr-Gly-Gly-L-Phe-L-Leu-L-Arg-L-Arg-D-Leu-OH
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: C47H74N14O10
Molecular formula furigana: C47-H74-N14-O10
Molecular weight: 995.197
InChI: InChI=1S/C47H74N14O10/c1-27(2)21-35(43(68)59-32(13-9-19-53-46(48)49)41(66)58-33(14-10-20-54-47(50)51)42(67)61-37(45(70)71)22-28(3)4)60-44(69)36(24-29-11-7-6-8-12-29)57-39(64)26-55-38(63)25-56-40(65)34(52-5)23-30-15-17-31(62)18-16-30/h6-8,11-12,15-18,27-28,32-37,52,62H,9-10,13-14,19-26H2,1-5H3,(H,55,63)(H,56,65)(H,57,64)(H,58,66)(H,59,68)(H,60,69)(H,61,67)(H,70,71)(H4,48,49,53)(H4,50,51,54)/t32-,33-,34-,35-,36-,37+/m0/s1
InChI key: YBTGNIHPUOTRIT-OZBJQVERSA-N
SMILES: CN[C@@H](Cc1ccc(O)cc1)C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)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)O
Systematic name  (3):
  • N-メチル-L-Tyr-Gly-Gly-L-Phe-L-Leu-L-Arg-L-Arg-D-Leu-OH
  • (2R)-2-[(2S)-5-カルバムイミドアミド-2-[(2S)-5-カルバムイミドアミド-2-[(2S)-2-[(2S)-2-(2-{2-[(2S)-3-(4-ヒドロキシフェニル)-2-(メチルアミノ)プロパンアミド]アセトアミド}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]ペンタンアミド]ペンタンアミド]-4-メチルペンタン酸
  • (2R)-2-[(2S)-5-carbamimidamido-2-[(2S)-5-carbamimidamido-2-[(2S)-2-[(2S)-2-(2-{2-[(2S)-3-(4-hydroxyphenyl)-2-(methylamino)propanamido]acetamido}acetamido)-3-phenylpropanamido]-4-methylpentanamido]pentanamido]pentanamido]-4-methylpentanoic acid
Other name (1):
  • N-Methyl-L-Tyr-Gly-Gly-L-Phe-L-Leu-L-Arg-L-Arg-D-Leu-OH
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