(3S)-3-azanyl-4-[[(2S,3R)-3,4-bis(oxidanyl)-1-oxidanylidene-1-[[(2S,3S,4R,5S,6R)-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]methylamino]butan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-3-azanyl-4-[[(2S,3R)-3,4-bis(oxidanyl)-1-oxidanylidene-1-[[(2S,3S,4R,5S,6R)-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]methylamino]butan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-amino-4-[[(1S,2R)-2,3-dihydroxy-1-[[(2S,3S,4R,5S,6R)-3,4,5,6-tetrahydroxytetrahydropyran-2-yl]methylcarbamoyl]propyl]amino]-4-oxo-butanoic acid CAS Name: (3S)-3-amino-4-[[(2S,3R)-3,4-dihydroxy-1-oxo-1-[[(2S,3S,4R,5S,6R)-3,4,5,6-tetrahydroxy-2-oxanyl]methylamino]butan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: (3S)-3-amino-4-[[(2S,3R)-3,4-dihydroxy-1-oxo-1-[[(2S,3S,4R,5S,6R)-3,4,5,6-tetrahydroxyoxan-2-yl]methylamino]butan-2-yl]amino]-4-oxobutanoic acid Traditional Name: (3S)-3-amino-4-[[(1S,2R)-2,3-dihydroxy-1-[[(2S,3S,4R,5S,6R)-3,4,5,6-tetrahydroxytetrahydropyran-2-yl]methylcarbamoyl]propyl]amino]-4-keto-butyric acid Formula: C14H25N3O11 MolecularWeight: 411.3618

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Descriptors Computed from Structure

Canonical SMILES:

C(C1C(C(C(C(O1)O)O)O)O)NC(=O)C(C(CO)O)NC(=O)C(CC(=O)O)N

Isomeric SMILES

C([C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O)O)O)O)NC(=O)[C@H]([C@H](CO)O)NC(=O)[C@H](CC(=O)O)N

InChI

InChI=1S/C14H25N3O11/c15-4(1-7(20)21)12(25)17-8(5(19)3-18)13(26)16-2-6-9(22)10(23)11(24)14(27)28-6/h4-6,8-11,14,18-19,22-24,27H,1-3,15H2,(H,16,26)(H,17,25)(H,20,21)/t4-,5-,6-,8-,9+,10+,11-,14+/m0/s1