(3S)-3-azanyl-4-[[(2S)-1-[[(2S)-6-azanyl-1-oxidanylidene-1-[[(2S)-1-oxidanylidene-1-[[(2S)-1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]propan-2-yl]amino]hexan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-3-azanyl-4-[[(2S)-1-[[(2S)-6-azanyl-1-oxidanylidene-1-[[(2S)-1-oxidanylidene-1-[[(2S)-1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]propan-2-yl]amino]hexan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-amino-4-[[(1S)-1-[[(1S)-5-amino-1-[[(1S)-2-[[(1S)-1-benzyl-2-hydroxy-2-oxo-ethyl]amino]-1-methyl-2-oxo-ethyl]carbamoyl]pentyl]carbamoyl]-2-methyl-propyl]amino]-4-oxo-butanoic acid CAS Name: (3S)-3-amino-4-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-hydroxy-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: (3S)-3-amino-4-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-hydroxy-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid Traditional Name: (3S)-3-amino-4-[[(1S)-1-[[(1S)-5-amino-1-[[(1S)-2-[[(1S)-1-benzyl-2-hydroxy-2-keto-ethyl]amino]-2-keto-1-methyl-ethyl]carbamoyl]pentyl]carbamoyl]-2-methyl-propyl]amino]-4-keto-butyric acid Formula: C27H42N6O8 MolecularWeight: 578.65778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CCCCN)C(=O)NC(C)C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)C(CC(=O)O)N

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(=O)O)N

InChI

InChI=1S/C27H42N6O8/c1-15(2)22(33-24(37)18(29)14-21(34)35)26(39)31-19(11-7-8-12-28)25(38)30-16(3)23(36)32-20(27(40)41)13-17-9-5-4-6-10-17/h4-6,9-10,15-16,18-20,22H,7-8,11-14,28-29H2,1-3H3,(H,30,38)(H,31,39)(H,32,36)(H,33,37)(H,34,35)(H,40,41)/t16-,18-,19-,20-,22-/m0/s1