Chem
J-GLOBAL ID：200907009335813950   Nikkaji number：J1.010.448C

L-Tyr-L-Gly-L-Gly-L-Phe-L-Leu-L-Arg-L-Gln-L-Phe-L-Lys-L-Val-OH

L-Tyr-L-Gly-L-Gly-L-Phe-L-Leu-L-Arg-L-Gln-L-Phe-L-Lys-L-Val-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： C59H87N15O13
Molecular formula furigana： C59-H87-N15-O13
Molecular weight： 1214.437
InChI： InChI=1S/C59H87N15O13/c1-34(2)28-44(72-56(84)45(30-36-14-7-5-8-15-36)68-49(78)33-66-48(77)32-67-51(79)40(61)29-38-20-22-39(75)23-21-38)55(83)70-42(19-13-27-65-59(63)64)52(80)71-43(24-25-47(62)76)53(81)73-46(31-37-16-9-6-10-17-37)57(85)69-41(18-11-12-26-60)54(82)74-50(35(3)4)58(86)87/h5-10,14-17,20-23,34-35,40-46,50,75H,11-13,18-19,24-33,60-61H2,1-4H3,(H2,62,76)(H,66,77)(H,67,79)(H,68,78)(H,69,85)(H,70,83)(H,71,80)(H,72,84)(H,73,81)(H,74,82)(H,86,87)(H4,63,64,65)/t40-,41-,42-,43-,44-,45-,46-,50-/m0/s1
InChI key： JDBGWLKFYNBCCJ-LOIMKWFISA-N
SMILES： CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)O
Systematic name  (3)：
  • L-Tyr-L-Gly-L-Gly-L-Phe-L-Leu-L-Arg-L-Gln-L-Phe-L-Lys-L-Val-OH
  • (2S)-2-[(2S)-6-アミノ-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-(2-{2-[(2S)-2-アミノ-3-(4-ヒドロキシフェニル)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]-5-カルバムイミドアミドペンタンアミド]-4-カルバモイルブタンアミド]-3-フェニルプロパンアミド]ヘキサンアミド]-3-メチルブタン酸
  • (2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-(2-{2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]acetamido}acetamido)-3-phenylpropanamido]-4-methylpentanamido]-5-carbamimidamidopentanamido]-4-carbamoylbutanamido]-3-phenylpropanamido]hexanamido]-3-methylbutanoic acid
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