[2-[[4-[5-(azidomethyl)-4-methoxy-4,6-dimethyl-5-oxidanyl-oxan-2-yl]oxy-14-ethyl-7-methoxy-3,5,7,9,11,13-hexamethyl-12,13-bis(oxidanyl)-2,10-bis(oxidanylidene)-1-oxacyclotetradec-6-yl]oxy]-4-(dimethylamino)-6-methyl-oxan-3-yl] ethanoate

Systemtic Name: [2-[[4-[5-(azidomethyl)-4-methoxy-4,6-dimethyl-5-oxidanyl-oxan-2-yl]oxy-14-ethyl-7-methoxy-3,5,7,9,11,13-hexamethyl-12,13-bis(oxidanyl)-2,10-bis(oxidanylidene)-1-oxacyclotetradec-6-yl]oxy]-4-(dimethylamino)-6-methyl-oxan-3-yl] ethanoate Openeye Name: [2-[[4-[5-(azidomethyl)-5-hydroxy-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-14-ethyl-12,13-dihydroxy-7-methoxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-4-(dimethylamino)-6-methyl-tetrahydropyran-3-yl] acetate CAS Name: acetic acid [2-[[4-[[5-(azidomethyl)-5-hydroxy-4-methoxy-4,6-dimethyl-2-oxanyl]oxy]-14-ethyl-12,13-dihydroxy-7-methoxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-4-(dimethylamino)-6-methyl-3-oxanyl] ester IUPAC Name: [2-[[4-[5-(azidomethyl)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-14-ethyl-12,13-dihydroxy-7-methoxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-4-(dimethylamino)-6-methyloxan-3-yl] acetate Traditional Name: acetic acid [2-[[4-[5-(azidomethyl)-5-hydroxy-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-14-ethyl-12,13-dihydroxy-2,10-diketo-7-methoxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradec-6-yl]oxy]-4-(dimethylamino)-6-methyl-tetrahydropyran-3-yl] ester Formula: C41H72N4O14 MolecularWeight: 845.02878

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)(CN=[N+]=[N-])O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)OC(=O)C)(C)OC)C)C)O)(C)O

Isomeric SMILES

CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)(CN=[N+]=[N-])O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)OC(=O)C)(C)OC)C)C)O)(C)O

InChI

InChI=1S/C41H72N4O14/c1-16-29-40(11,50)34(48)23(4)31(47)21(2)18-38(9,52-14)35(59-37-33(56-27(8)46)28(45(12)13)17-22(3)54-37)24(5)32(25(6)36(49)57-29)58-30-19-39(10,53-15)41(51,20-43-44-42)26(7)55-30/h21-26,28-30,32-35,37,48,50-51H,16-20H2,1-15H3