17-[2-(3,4-dichlorophenyl)ethyl]-7-[4-(2,5-dipropylpyrrolidin-1-yl)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-13-ethyl-6-methoxy-9-(4-methoxy-4,6-dimethyl-5-oxidanyl-oxan-2-yl)oxy-2,4,6,8,10,14-hexamethyl-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,11,16-trione

Systemtic Name: 17-[2-(3,4-dichlorophenyl)ethyl]-7-[4-(2,5-dipropylpyrrolidin-1-yl)-6-methyl-3-oxidanyl-oxan-2-yl]oxy-13-ethyl-6-methoxy-9-(4-methoxy-4,6-dimethyl-5-oxidanyl-oxan-2-yl)oxy-2,4,6,8,10,14-hexamethyl-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,11,16-trione Openeye Name: 17-[2-(3,4-dichlorophenyl)ethyl]-7-[4-(2,5-dipropylpyrrolidin-1-yl)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-13-ethyl-9-(5-hydroxy-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-6-methoxy-2,4,6,8,10,14-hexamethyl-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,11,16-trione CAS Name: 17-[2-(3,4-dichlorophenyl)ethyl]-7-[[4-(2,5-dipropyl-1-pyrrolidinyl)-3-hydroxy-6-methyl-2-oxanyl]oxy]-13-ethyl-9-[(5-hydroxy-4-methoxy-4,6-dimethyl-2-oxanyl)oxy]-6-methoxy-2,4,6,8,10,14-hexamethyl-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,11,16-trione IUPAC Name: 17-[2-(3,4-dichlorophenyl)ethyl]-7-[4-(2,5-dipropylpyrrolidin-1-yl)-3-hydroxy-6-methyloxan-2-yl]oxy-13-ethyl-9-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-6-methoxy-2,4,6,8,10,14-hexamethyl-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,11,16-trione Traditional Name: 17-[2-(3,4-dichlorophenyl)ethyl]-7-[4-(2,5-dipropylpyrrolidino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-13-ethyl-9-(5-hydroxy-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-6-methoxy-2,4,6,8,10,14-hexamethyl-12,15-dioxa-17-azabicyclo[12.3.0]heptadecane-3,11,16-trione Formula: C55H88Cl2N2O13 MolecularWeight: 1056.19882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(N1C2CC(OC(C2O)OC3C(C(C(C(=O)OC(C4(C(C(C(=O)C(CC3(C)OC)C)C)N(C(=O)O4)CCC5=CC(=C(C=C5)Cl)Cl)C)CC)C)OC6CC(C(C(O6)C)O)(C)OC)C)C)CCC

Isomeric SMILES

CCCC1CCC(N1C2CC(OC(C2O)OC3C(C(C(C(=O)OC(C4(C(C(C(=O)C(CC3(C)OC)C)C)N(C(=O)O4)CCC5=CC(=C(C=C5)Cl)Cl)C)CC)C)OC6CC(C(C(O6)C)O)(C)OC)C)C)CCC

InChI

InChI=1S/C55H88Cl2N2O13/c1-15-18-37-21-22-38(19-16-2)59(37)41-26-31(5)67-51(45(41)61)71-49-33(7)46(70-43-29-53(10,65-13)48(62)35(9)68-43)34(8)50(63)69-42(17-3)55(12)47(32(6)44(60)30(4)28-54(49,11)66-14)58(52(64)72-55)25-24-36-20-23-39(56)40(57)27-36/h20,23,27,30-35,37-38,41-43,45-49,51,61-62H,15-19,21-22,24-26,28-29H2,1-14H3