Chem
J-GLOBAL ID：200907006905488064   Nikkaji number：J640.707B

Ac-YVAD-CHO

Ac-YVAD-CHO
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： C23H32N4O8
Molecular formula furigana： C23-H32-N4-O8
Molecular weight： 492.529
InChI： InChI=1S/C23H32N4O8/c1-12(2)20(23(35)24-13(3)21(33)26-16(11-28)10-19(31)32)27-22(34)18(25-14(4)29)9-15-5-7-17(30)8-6-15/h5-8,11-13,16,18,20,30H,9-10H2,1-4H3,(H,24,35)(H,25,29)(H,26,33)(H,27,34)(H,31,32)/t13-,16-,18-,20-/m0/s1
InChI key： LPIARALSGDVZEP-SJVNDZIOSA-N
SMILES： CC(C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C=O
Systematic name  (16)：
  • (S)-3-ホルミル-3-[[Ac-L-Tyr-L-Val-L-Ala-]アミノ]プロパン酸
  • Ac-L-Tyr-L-Val-L-Ala-[(S)-1-ホルミル-3-オキソ-3-ヒドロキシプロピル]NH2
  • (S)-4-ヒドロキシ-4-オキソ-2-[[Ac-L-Tyr-L-Val-L-Ala-]アミノ]ブタナール
  • (3S)-N-(Ac-L-Tyr-L-Val-L-Ala-)-3-ホルミル-β-アラニン
  • Ac-L-Tyr-L-Val-L-Ala-[(S)-3-ホルミル-βAla-]-OH
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Other name (12)：
  • L-709049
  • (2S)-2-[(Ac-Tyr-Val-Ala-)Amino]-4-oxo-4-hydroxybutanal
  • Ac-L-Tyr-L-Val-L-Ala-[(S)-1-Formyl-2-carboxyethyl]NH2
  • (S)-3-[(Ac-Tyr-Val-Ala-)Amino]-4-oxobutanoic acid
  • Ac-YVAD-CHO
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CAS registry number： 143313-51-3
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