(4S)-5-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-5-oxidanylidene-4-(tetradecanoylamino)pentanoic acid

Systemtic Name: (4S)-5-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-5-oxidanylidene-4-(tetradecanoylamino)pentanoic acid Openeye Name: (4S)-5-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]amino]-5-oxo-4-(tetradecanoylamino)pentanoic acid CAS Name: (4S)-5-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-5-oxo-4-(1-oxotetradecylamino)pentanoic acid IUPAC Name: (4S)-5-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-5-oxo-4-(tetradecanoylamino)pentanoic acid Traditional Name: (4S)-5-[[(1S)-2-amino-1-benzyl-2-keto-ethyl]amino]-5-keto-4-(tetradecanoylamino)valeric acid Formula: C28H45N3O5 MolecularWeight: 503.674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NC(CCC(=O)O)C(=O)NC(CC1=CC=CC=C1)C(=O)N

Isomeric SMILES

CCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N

InChI

InChI=1S/C28H45N3O5/c1-2-3-4-5-6-7-8-9-10-11-15-18-25(32)30-23(19-20-26(33)34)28(36)31-24(27(29)35)21-22-16-13-12-14-17-22/h12-14,16-17,23-24H,2-11,15,18-21H2,1H3,(H2,29,35)(H,30,32)(H,31,36)(H,33,34)/t23-,24-/m0/s1