Chem
J-GLOBAL ID:200907024623180871   Nikkaji number:J460.607H

L-Tyr-D-Orn(1)-4-Phenyl-L-Abu-L-Glu(1)-NH2

L-Tyr-D-Orn(1)-4-フェニル-L-Abu-L-Glu(1)-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: C29H38N6O6
Molecular formula furigana: C29-H38-N6-O6
Molecular weight: 566.659
InChI: InChI=1S/C29H38N6O6/c30-21(17-19-8-11-20(36)12-9-19)27(39)34-23-7-4-16-32-25(37)15-14-22(26(31)38)33-29(41)24(35-28(23)40)13-10-18-5-2-1-3-6-18/h1-3,5-6,8-9,11-12,21-24,36H,4,7,10,13-17,30H2,(H2,31,38)(H,32,37)(H,33,41)(H,34,39)(H,35,40)/t21-,22-,23?,24?/m0/s1
InChI key: MVRHQFUASVSYDB-WOLZVPSQSA-N
SMILES: N[C@@H](Cc1ccc(O)cc1)C(=O)NC1CCCNC(=O)CC[C@H](NC(=O)C(CCc2ccccc2)NC1=O)C(=O)N
Systematic name  (3):
  • L-Tyr-D-Orn(1)-4-フェニル-L-Abu-L-Glu(1)-NH2
  • (2S,5S,13R)-13-[(2S)-2-アミノ-3-(4-ヒドロキシフェニル)プロパンアミド]-3,8,14-トリオキソ-2-(2-フェニルエチル)-1,4,9-トリアザシクロテトラデカン-5-カルボキサミド
  • (2S,5S,13R)-13-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3,8,14-trioxo-2-(2-phenylethyl)-1,4,9-triazacyclotetradecane-5-carboxamide
Other name (1):
  • L-Tyr-D-Orn(1)-4-Phenyl-L-Abu-L-Glu(1)-NH2
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