CC[C@@H](C)[C@@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(Cc1ccccc1)C(=O)O)C(=O)O

Nombre: N-benzyloxycarbonyl-β-benzyl-L-aspartyl-D-isoleucine

IUPAC: (2R,3R)-2-[[(2S)-3-carboxy-4-phenyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-methylpentanoic acid

SMILES: CC[C@@H](C)[C@@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(Cc1ccccc1)C(=O)O)C(=O)O

Canonical SMILES: CCC(C)C(C(=O)O)NC(=O)C(C(CC1=CC=CC=C1)C(=O)O)NC(=O)OCC2=CC=CC=C2

Fórmula molecular: C25H30N2O7

Masa molecular: 470.50

InChIKey: ZEOWGJFFHUBHOW-ZNDGOPKYSA-N

InChI:

InChI=1S/C25H30N2O7/c1-3-16(2)20(24(31)32)26-22(28)21(19(23(29)30)14-17-10-6-4-7-11-17)27-25(33)34-15-18-12-8-5-9-13-18/h4-13,16,19-21H,3,14-15H2,1-2H3,(H,26,28)(H,27,33)(H,29,30)(H,31,32)/t16-,19?,20-,21+/m1/s1

PubChem CID: 54543031 →

Sinónimos

SCHEMBL7757126ZEOWGJFFHUBHOW-ZNDGOPKYSA-NN-benzyloxycarbonyl-beta-benzyl-L-aspartyl-D-isoleucine

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