methyl 2-[[3-[(2S,3S,4R,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]-2-[2-[(2S,3S,4R,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]ethanoylamino]propanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[3-[(2S,3S,4R,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]-2-[2-[(2S,3S,4R,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]ethanoylamino]propanoyl]amino]ethanoate Openeye Name: methyl 2-[[3-[(2S,3S,4R,5S,6R)-3,4,5-tribenzyloxy-6-(benzyloxymethyl)tetrahydropyran-2-yl]-2-[[2-[(2S,3S,4R,5S,6R)-3,4,5-tribenzyloxy-6-(benzyloxymethyl)tetrahydropyran-2-yl]acetyl]amino]propanoyl]amino]acetate CAS Name: 2-[[1-oxo-2-[[1-oxo-2-[(2S,3S,4R,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)-2-oxanyl]ethyl]amino]-3-[(2S,3S,4R,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)-2-oxanyl]propyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-[(2S,3S,4R,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]-2-[[2-[(2S,3S,4R,5S,6R)-3,4,5-tris(phenylmethoxy)-6-(phenylmethoxymethyl)oxan-2-yl]acetyl]amino]propanoyl]amino]acetate Traditional Name: 2-[[3-[(2S,3S,4R,5S,6R)-3,4,5-tribenzoxy-6-(benzoxymethyl)tetrahydropyran-2-yl]-2-[[2-[(2S,3S,4R,5S,6R)-3,4,5-tribenzoxy-6-(benzoxymethyl)tetrahydropyran-2-yl]acetyl]amino]propanoyl]amino]acetic acid methyl ester Formula: C76H82N2O14 MolecularWeight: 1247.46928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C(CC1C(C(C(C(O1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)NC(=O)CC6C(C(C(C(O6)COCC7=CC=CC=C7)OCC8=CC=CC=C8)OCC9=CC=CC=C9)OCC1=CC=CC=C1

Isomeric SMILES

COC(=O)CNC(=O)C(C[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5)NC(=O)C[C@H]6[C@@H]([C@H]([C@H]([C@H](O6)COCC7=CC=CC=C7)OCC8=CC=CC=C8)OCC9=CC=CC=C9)OCC1=CC=CC=C1

InChI

InChI=1S/C76H82N2O14/c1-82-69(80)44-77-76(81)63(42-64-70(85-47-57-30-14-4-15-31-57)74(89-51-61-38-22-8-23-39-61)72(87-49-59-34-18-6-19-35-59)66(91-64)53-83-45-55-26-10-2-11-27-55)78-68(79)43-65-71(86-48-58-32-16-5-17-33-58)75(90-52-62-40-24-9-25-41-62)73(88-50-60-36-20-7-21-37-60)67(92-65)54-84-46-56-28-12-3-13-29-56/h2-41,63-67,70-75H,42-54H2,1H3,(H,77,81)(H,78,79)/t63?,64-,65-,66+,67+,70-,71-,72-,73-,74+,75+/m0/s1