Chem
J-GLOBAL ID：201607010284462530   Nikkaji number：J3.511.467J

4-(131I)Iodo-L-Phe-L-Lys-L-Cys-L-Cys-L-Tyr-L-Ser-L-Leu-OH

4-(131I)ヨード-L-Phe-L-Lys-L-Cys-L-Cys-L-Tyr-L-Ser-L-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： C39H57[131I]N8O10S2
Molecular formula furigana： C39-H57-I-N8-O10-S2
Molecular weight： 992.960
InChI： InChI=1S/C39H57IN8O10S2/c1-21(2)15-29(39(57)58)45-36(54)30(18-49)46-35(53)28(17-23-8-12-25(50)13-9-23)44-37(55)31(19-59)48-38(56)32(20-60)47-34(52)27(5-3-4-14-41)43-33(51)26(42)16-22-6-10-24(40)11-7-22/h6-13,21,26-32,49-50,59-60H,3-5,14-20,41-42H2,1-2H3,(H,43,51)(H,44,55)(H,45,54)(H,46,53)(H,47,52)(H,48,56)(H,57,58)/t26-,27-,28-,29-,30-,31-,32-/m0/s1/i40+4
InChI key： MLOURYRKTGBXOL-ZJNBWLGXSA-N
SMILES： CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1ccc([131I])cc1)C(=O)O
Systematic name  (3)：
  • 4-(131I)ヨード-L-Phe-L-Lys-L-Cys-L-Cys-L-Tyr-L-Ser-L-Leu-OH
  • (2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-6-アミノ-2-[(2S)-2-アミノ-3-[4-(131I)ヨードフェニル]プロパンアミド]ヘキサンアミド]-3-スルファニルプロパンアミド]-3-スルファニルプロパンアミド]-3-(4-ヒドロキシフェニル)プロパンアミド]-3-ヒドロキシプロパンアミド]-4-メチルペンタン酸
  • (2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-[(2S)-6-amino-2-[(2S)-2-amino-3-[4-(131I)iodophenyl]propanamido]hexanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-4-methylpentanoic acid
Other name (1)：
  • 4-(131I)Iodo-L-Phe-L-Lys-L-Cys-L-Cys-L-Tyr-L-Ser-L-Leu-OH
Thsaurus map：
Thesaurus Map

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