Chem
J-GLOBAL ID:200907098102188489   Nikkaji number:J1.704.192D

(S)-2-[(N-Butyryl-L-Tyr-L-Leu-)amino]-3-(4-hydroxyphenyl)propanal

(S)-2-[(N-ブチリル-L-Tyr-L-Leu-)アミノ]-3-(4-ヒドロキシフェニル)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: C28H37N3O6
Molecular formula furigana: C28-H37-N3-O6
Molecular weight: 511.619
InChI: InChI=1S/C28H37N3O6/c1-4-5-26(35)30-25(16-20-8-12-23(34)13-9-20)28(37)31-24(14-18(2)3)27(36)29-21(17-32)15-19-6-10-22(33)11-7-19/h6-13,17-18,21,24-25,33-34H,4-5,14-16H2,1-3H3,(H,29,36)(H,30,35)(H,31,37)/t21-,24-,25-/m0/s1
InChI key: SYAOZPXWOOYNES-TUSQITKMSA-N
SMILES: CCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C=O
Systematic name  (3):
  • (S)-2-[(N-ブチリル-L-Tyr-L-Leu-)アミノ]-3-(4-ヒドロキシフェニル)プロパナール
  • (2S)-2-[(2S)-2-ブタンアミド-3-(4-ヒドロキシフェニル)プロパンアミド]-N-[(2S)-1-(4-ヒドロキシフェニル)-3-オキソプロパン-2-イル]-4-メチルペンタンアミド
  • (2S)-2-[(2S)-2-butanamido-3-(4-hydroxyphenyl)propanamido]-N-[(2S)-1-(4-hydroxyphenyl)-3-oxopropan-2-yl]-4-methylpentanamide
Other name (1):
  • (S)-2-[(N-Butyryl-L-Tyr-L-Leu-)amino]-3-(4-hydroxyphenyl)propanal
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