Chem
J-GLOBAL ID：200907067792240205   Nikkaji number：J2.231.650H

(S)-2-[[N-(1-Naphthylacetyl)-L-Tyr-L-Val-]amino]-3-(4-methoxyphenyl)propanal

(S)-2-[[N-(1-ナフチルアセチル)-L-Tyr-L-Val-]アミノ]-3-(4-メトキシフェニル)プロパナール
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： C36H39N3O6
Molecular formula furigana： C36-H39-N3-O6
Molecular weight： 609.723
InChI： InChI=1S/C36H39N3O6/c1-23(2)34(36(44)37-28(22-40)19-24-13-17-30(45-3)18-14-24)39-35(43)32(20-25-11-15-29(41)16-12-25)38-33(42)21-27-9-6-8-26-7-4-5-10-31(26)27/h4-18,22-23,28,32,34,41H,19-21H2,1-3H3,(H,37,44)(H,38,42)(H,39,43)/t28-,32-,34-/m0/s1
InChI key： YKULOXYTLSPQGO-URBDOXFBSA-N
SMILES： COc1ccc(C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)Cc2cccc3ccccc23)C(C)C)C=O)cc1
Systematic name  (3)：
  • (S)-2-[[N-(1-ナフチルアセチル)-L-Tyr-L-Val-]アミノ]-3-(4-メトキシフェニル)プロパナール
  • (2S)-2-[(2S)-3-(4-ヒドロキシフェニル)-2-[2-(ナフタレン-1-イル)アセトアミド]プロパンアミド]-N-[(2S)-1-(4-メトキシフェニル)-3-オキソプロパン-2-イル]-3-メチルブタンアミド
  • (2S)-2-[(2S)-3-(4-hydroxyphenyl)-2-[2-(naphthalen-1-yl)acetamido]propanamido]-N-[(2S)-1-(4-methoxyphenyl)-3-oxopropan-2-yl]-3-methylbutanamide
Other name (1)：
  • (S)-2-[[N-(1-Naphthylacetyl)-L-Tyr-L-Val-]amino]-3-(4-methoxyphenyl)propanal
Thsaurus map：
Thesaurus Map

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