Chem
J-GLOBAL ID:200907053824879040   Nikkaji number:J1.314.917H

(S)-2-[[(S)-3-[[(R)-1-Aminoethyl]phosphonyl]-2-(1,1′-biphenyl-4-ylmethyl)propanoyl]amino]propanoic acid

(S)-2-[[(S)-3-[[(R)-1-アミノエチル]ホスホニル]-2-(1,1′-ビフェニル-4-イルメチル)プロパノイル]アミノ]プロパン酸
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: C21H27N2O5P
Molecular formula furigana: C21-H27-N2-O5-P
Molecular weight: 418.430
InChI: InChI=1S/C21H27N2O5P/c1-14(21(25)26)23-20(24)19(13-29(27,28)15(2)22)12-16-8-10-18(11-9-16)17-6-4-3-5-7-17/h3-11,14-15,19H,12-13,22H2,1-2H3,(H,23,24)(H,25,26)(H,27,28)/t14-,15+,19+/m0/s1
InChI key: CWJPVKSBGVPXRD-QMTMVMCOSA-N
SMILES: C[C@H](N)P(=O)(O)C[C@@H](Cc1ccc(cc1)c1ccccc1)C(=O)N[C@@H](C)C(=O)O
Systematic name  (3):
  • (S)-2-[[(S)-3-[[(R)-1-アミノエチル]ホスホニル]-2-(1,1′-ビフェニル-4-イルメチル)プロパノイル]アミノ]プロパン酸
  • (2S)-2-[(2S)-3-{[(1R)-1-アミノエチル](ヒドロキシ)ホスホリル}-2-({[1,1'-ビフェニル]-4-イル}メチル)プロパンアミド]プロパン酸
  • (2S)-2-[(2S)-3-{[(1R)-1-aminoethyl](hydroxy)phosphoryl}-2-({[1,1'-biphenyl]-4-yl}methyl)propanamido]propanoic acid
Other name (1):
  • (S)-2-[[(S)-3-[[(R)-1-Aminoethyl]phosphonyl]-2-(1,1′-biphenyl-4-ylmethyl)propanoyl]amino]propanoic acid
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