tert-butyl N-[(2S)-1-[[(2S)-1-[[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[[(2S)-1-[[(2S,3R,4R,5S,6R)-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-benzyl-2-[[(1S)-3-methyl-1-[[(2S,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]carbamoyl]butyl]amino]-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[[(2S)-4-methyl-1-oxo-1-[[(2S,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)-3-oxanyl]amino]pentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[[(2S)-4-methyl-1-oxo-1-[[(2S,3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]amino]pentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-keto-2-[[(1S)-3-methyl-1-[[(2S,3R,4R,5S,6R)-2,4,5-trihydroxy-6-methylol-tetrahydropyran-3-yl]carbamoyl]butyl]amino]ethyl]carbamic acid tert-butyl ester Formula: C26H41N3O9 MolecularWeight: 539.61844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1C(C(C(OC1O)CO)O)O)NC(=O)C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1O)CO)O)O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H41N3O9/c1-14(2)11-16(23(34)29-19-21(32)20(31)18(13-30)37-24(19)35)27-22(33)17(12-15-9-7-6-8-10-15)28-25(36)38-26(3,4)5/h6-10,14,16-21,24,30-32,35H,11-13H2,1-5H3,(H,27,33)(H,28,36)(H,29,34)/t16-,17-,18+,19+,20+,21+,24-/m0/s1