(phenylmethyl) N-[2-[[(2S)-2-acetamido-3-[(2S,3R,4R,5R,6R)-3-acetamido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-propanoyl]amino]ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-[[(2S)-2-acetamido-3-[(2S,3R,4R,5R,6R)-3-acetamido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-2-yl]oxy-propanoyl]amino]ethyl]carbamate Openeye Name: benzyl N-[2-[[(2S)-2-acetamido-3-[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-propanoyl]amino]ethyl]carbamate CAS Name: N-[2-[[(2S)-2-acetamido-3-[[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-1-oxopropyl]amino]ethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[[(2S)-2-acetamido-3-[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropanoyl]amino]ethyl]carbamate Traditional Name: N-[2-[[(2S)-2-acetamido-3-[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-propanoyl]amino]ethyl]carbamic acid benzyl ester Formula: C23H34N4O10 MolecularWeight: 526.53686

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C(C(OC1OCC(C(=O)NCCNC(=O)OCC2=CC=CC=C2)NC(=O)C)CO)O)O

Isomeric SMILES

CC(=O)N[C@@H]1[C@H]([C@H]([C@H](O[C@@H]1OC[C@@H](C(=O)NCCNC(=O)OCC2=CC=CC=C2)NC(=O)C)CO)O)O

InChI

InChI=1S/C23H34N4O10/c1-13(29)26-16(12-35-22-18(27-14(2)30)20(32)19(31)17(10-28)37-22)21(33)24-8-9-25-23(34)36-11-15-6-4-3-5-7-15/h3-7,16-20,22,28,31-32H,8-12H2,1-2H3,(H,24,33)(H,25,34)(H,26,29)(H,27,30)/t16-,17+,18+,19-,20+,22-/m0/s1