(3S)-3-[[(2S)-2-[[(2S)-2-azanyl-3-(1H-imidazol-5-yl)propanoyl]amino]-3-oxidanyl-propanoyl]amino]-4-[[2-[[(2S,3R)-1,3-bis(oxidanyl)-1-oxidanylidene-butan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-3-[[(2S)-2-[[(2S)-2-azanyl-3-(1H-imidazol-5-yl)propanoyl]amino]-3-oxidanyl-propanoyl]amino]-4-[[2-[[(2S,3R)-1,3-bis(oxidanyl)-1-oxidanylidene-butan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-4-[[2-[[(1S,2R)-1-carboxy-2-hydroxy-propyl]amino]-2-oxo-ethyl]amino]-4-oxo-butanoic acid CAS Name: (3S)-3-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]-3-hydroxy-1-oxopropyl]amino]-4-[[2-[[(2S,3R)-1,3-dihydroxy-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-4-oxobutanoic acid IUPAC Name: (3S)-3-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-4-[[2-[[(2S,3R)-1,3-dihydroxy-1-oxobutan-2-yl]amino]-2-oxoethyl]amino]-4-oxobutanoic acid Traditional Name: (3S)-3-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-hydroxy-propanoyl]amino]-4-[[2-[[(1S,2R)-1-carboxy-2-hydroxy-propyl]amino]-2-keto-ethyl]amino]-4-keto-butyric acid Formula: C19H29N7O10 MolecularWeight: 515.47446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)CNC(=O)C(CC(=O)O)NC(=O)C(CO)NC(=O)C(CC1=CN=CN1)N)O

Isomeric SMILES

C[C@H]([C@@H](C(=O)O)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC1=CN=CN1)N)O

InChI

InChI=1S/C19H29N7O10/c1-8(28)15(19(35)36)26-13(29)5-22-17(33)11(3-14(30)31)24-18(34)12(6-27)25-16(32)10(20)2-9-4-21-7-23-9/h4,7-8,10-12,15,27-28H,2-3,5-6,20H2,1H3,(H,21,23)(H,22,33)(H,24,34)(H,25,32)(H,26,29)(H,30,31)(H,35,36)/t8-,10+,11+,12+,15+/m1/s1