Chem
J-GLOBAL ID:200907027815568678   Nikkaji number:J863.122K

D-Arg-L-Arg-L-Pro-L-t4Hyp-Gly-L-Phe-L-Ser-D-Phe-L-Phe-OH

D-Arg-L-Arg-L-Pro-L-t4Hyp-Gly-L-Phe-L-Ser-D-Phe-L-Phe-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: C54H75N15O12
Molecular formula furigana: C54-H75-N15-O12
Molecular weight: 1126.287
InChI: InChI=1S/C54H75N15O12/c55-36(19-10-22-60-53(56)57)45(73)64-37(20-11-23-61-54(58)59)50(78)68-24-12-21-42(68)51(79)69-30-35(71)28-43(69)49(77)62-29-44(72)63-38(25-32-13-4-1-5-14-32)46(74)67-41(31-70)48(76)65-39(26-33-15-6-2-7-16-33)47(75)66-40(52(80)81)27-34-17-8-3-9-18-34/h1-9,13-18,35-43,70-71H,10-12,19-31,55H2,(H,62,77)(H,63,72)(H,64,73)(H,65,76)(H,66,75)(H,67,74)(H,80,81)(H4,56,57,60)(H4,58,59,61)/t35-,36-,37+,38+,39-,40+,41+,42+,43+/m1/s1
InChI key: IBNWXHYRIVPSRU-NNARQTHJSA-N
SMILES: N[C@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N1C[C@H](O)C[C@H]1C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O
Systematic name  (3):
  • D-Arg-L-Arg-L-Pro-L-t4Hyp-Gly-L-Phe-L-Ser-D-Phe-L-Phe-OH
  • (2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-(2-{[(2S,4R)-1-[(2S)-1-[(2S)-2-[(2R)-2-アミノ-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ノイル]ピロリジン-2-カルボニル]-4-ヒドロキシピロリジン-2-イル]ホルムアミド}アセトアミド)-3-フェニルプロパンアミド]-3-ヒドロキシプロパンアミド]-3-フェニルプロパンアミド]-3-フェニルプロパン酸
  • (2S)-2-[(2R)-2-[(2S)-2-[(2S)-2-(2-{[(2S,4R)-1-[(2S)-1-[(2S)-2-[(2R)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]-4-hydroxypyrrolidin-2-yl]formamido}acetamido)-3-phenylpropanamido]-3-hydroxypropanamido]-3-phenylpropanamido]-3-phenylpropanoic acid
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