(1R,2S,3R,4R,5R)-4-azido-2-[(2S,3R,4S,5S,6R)-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)-4-[(E)-prop-1-enoxy]oxan-2-yl]oxy-3-[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-6,8-dioxabicyclo[3.2.1]octane

Systemtic Name: (1R,2S,3R,4R,5R)-4-azido-2-[(2S,3R,4S,5S,6R)-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)-4-[(E)-prop-1-enoxy]oxan-2-yl]oxy-3-[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-6,8-dioxabicyclo[3.2.1]octane Openeye Name: (1R,2S,3R,4R,5R)-4-azido-2-[(2S,3R,4S,5S,6R)-3,5-dibenzyloxy-6-(benzyloxymethyl)-4-[(E)-prop-1-enoxy]tetrahydropyran-2-yl]oxy-3-[(2S,3S,4R,5R,6S)-3,4,5-tribenzyloxy-6-methyl-tetrahydropyran-2-yl]oxy-6,8-dioxabicyclo[3.2.1]octane CAS Name: (1R,2S,3R,4R,5R)-4-azido-2-[[(2S,3R,4S,5S,6R)-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)-4-[(E)-prop-1-enoxy]-2-oxanyl]oxy]-3-[[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)-2-oxanyl]oxy]-6,8-dioxabicyclo[3.2.1]octane IUPAC Name: (1R,2S,3R,4R,5R)-4-azido-2-[(2S,3R,4S,5S,6R)-3,5-bis(phenylmethoxy)-6-(phenylmethoxymethyl)-4-[(E)-prop-1-enoxy]oxan-2-yl]oxy-3-[(2S,3S,4R,5R,6S)-6-methyl-3,4,5-tris(phenylmethoxy)oxan-2-yl]oxy-6,8-dioxabicyclo[3.2.1]octane Traditional Name: (1R,2S,3R,4R,5R)-4-azido-2-[(2S,3R,4S,5S,6R)-3,5-dibenzoxy-6-(benzoxymethyl)-4-[(E)-prop-1-enoxy]tetrahydropyran-2-yl]oxy-3-[(2S,3S,4R,5R,6S)-3,4,5-tribenzoxy-6-methyl-tetrahydropyran-2-yl]oxy-6,8-dioxabicyclo[3.2.1]octane Formula: C63H69N3O13 MolecularWeight: 1076.23426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=COC1C(C(OC(C1OCC2=CC=CC=C2)OC3C4COC(O4)C(C3OC5C(C(C(C(O5)C)OCC6=CC=CC=C6)OCC7=CC=CC=C7)OCC8=CC=CC=C8)N=[N+]=[N-])COCC9=CC=CC=C9)OCC1=CC=CC=C1

Isomeric SMILES

C/C=C/O[C@H]1[C@H]([C@H](O[C@H]([C@@H]1OCC2=CC=CC=C2)O[C@@H]3[C@H]4CO[C@H](O4)[C@@H]([C@H]3O[C@H]5[C@H]([C@@H]([C@@H]([C@@H](O5)C)OCC6=CC=CC=C6)OCC7=CC=CC=C7)OCC8=CC=CC=C8)N=[N+]=[N-])COCC9=CC=CC=C9)OCC1=CC=CC=C1

InChI

InChI=1S/C63H69N3O13/c1-3-34-68-58-54(70-37-46-26-14-6-15-27-46)50(41-67-35-44-22-10-4-11-23-44)77-63(60(58)73-40-49-32-20-9-21-33-49)78-55-51-42-74-61(76-51)52(65-66-64)56(55)79-62-59(72-39-48-30-18-8-19-31-48)57(71-38-47-28-16-7-17-29-47)53(43(2)75-62)69-36-45-24-12-5-13-25-45/h3-34,43,50-63H,35-42H2,1-2H3/b34-3+/t43-,50+,51+,52+,53+,54-,55+,56+,57+,58-,59-,60+,61+,62-,63-/m0/s1