prop-2-enyl (2S,3S,4S,5R,6S)-3,4,5-tris(prop-2-enoxycarbonyloxy)-6-[[4-[[4-[[(2S,3R,4S,5S,6S)-6-prop-2-enoxycarbonyl-3,4,5-tris(prop-2-enoxycarbonyloxy)oxan-2-yl]oxycarbonylamino]phenyl]methoxymethyl]phenyl]carbamoyloxy]oxane-2-carboxylate

Systemtic Name: prop-2-enyl (2S,3S,4S,5R,6S)-3,4,5-tris(prop-2-enoxycarbonyloxy)-6-[[4-[[4-[[(2S,3R,4S,5S,6S)-6-prop-2-enoxycarbonyl-3,4,5-tris(prop-2-enoxycarbonyloxy)oxan-2-yl]oxycarbonylamino]phenyl]methoxymethyl]phenyl]carbamoyloxy]oxane-2-carboxylate Openeye Name: allyl (2S,3S,4S,5R,6S)-3,4,5-tris(allyloxycarbonyloxy)-6-[[4-[[4-[[(2S,3R,4S,5S,6S)-6-allyloxycarbonyl-3,4,5-tris(allyloxycarbonyloxy)tetrahydropyran-2-yl]oxycarbonylamino]phenyl]methoxymethyl]phenyl]carbamoyloxy]tetrahydropyran-2-carboxylate CAS Name: (2S,3S,4S,5R,6S)-6-[oxo-[4-[[4-[[oxo-[[(2S,3R,4S,5S,6S)-3,4,5-tris[oxo(prop-2-enoxy)methoxy]-6-[oxo(prop-2-enoxy)methyl]-2-oxanyl]oxy]methyl]amino]phenyl]methoxymethyl]anilino]methoxy]-3,4,5-tris[oxo(prop-2-enoxy)methoxy]-2-oxanecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S,3S,4S,5R,6S)-3,4,5-tris(prop-2-enoxycarbonyloxy)-6-[[4-[[4-[[(2S,3R,4S,5S,6S)-6-prop-2-enoxycarbonyl-3,4,5-tris(prop-2-enoxycarbonyloxy)oxan-2-yl]oxycarbonylamino]phenyl]methoxymethyl]phenyl]carbamoyloxy]oxane-2-carboxylate Traditional Name: (2S,3S,4S,5R,6S)-3,4,5-tris(allyloxycarbonyloxy)-6-[[4-[[4-[[(2S,3R,4S,5S,6S)-6-allyloxycarbonyl-3,4,5-tris(allyloxycarbonyloxy)tetrahydropyran-2-yl]oxycarbonylamino]benzyl]oxymethyl]phenyl]carbamoyloxy]tetrahydropyran-2-carboxylic acid allyl ester Formula: C58H64N2O29 MolecularWeight: 1253.12476

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C1C(C(C(C(O1)OC(=O)NC2=CC=C(C=C2)COCC3=CC=C(C=C3)NC(=O)OC4C(C(C(C(O4)C(=O)OCC=C)OC(=O)OCC=C)OC(=O)OCC=C)OC(=O)OCC=C)OC(=O)OCC=C)OC(=O)OCC=C)OC(=O)OCC=C

Isomeric SMILES

C=CCOC(=O)[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC(=O)NC2=CC=C(C=C2)COCC3=CC=C(C=C3)NC(=O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)OCC=C)OC(=O)OCC=C)OC(=O)OCC=C)OC(=O)OCC=C)OC(=O)OCC=C)OC(=O)OCC=C)OC(=O)OCC=C

InChI

InChI=1S/C58H64N2O29/c1-9-25-72-47(61)43-39(82-53(65)74-27-11-3)41(84-55(67)76-29-13-5)45(86-57(69)78-31-15-7)49(80-43)88-51(63)59-37-21-17-35(18-22-37)33-71-34-36-19-23-38(24-20-36)60-52(64)89-50-46(87-58(70)79-32-16-8)42(85-56(68)77-30-14-6)40(83-54(66)75-28-12-4)44(81-50)48(62)73-26-10-2/h9-24,39-46,49-50H,1-8,25-34H2,(H,59,63)(H,60,64)/t39-,40-,41-,42-,43-,44-,45+,46+,49-,50-/m0/s1