[3-[5-(4,5-dimethanoyloxy-6-methyl-oxan-2-yl)oxy-4-methanoyloxy-6-methyl-oxan-2-yl]oxy-6-[[10,13-dimethyl-14-oxidanyl-17-(5-oxidanylidene-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-methyl-oxan-4-yl] methanoate

Systemtic Name: [3-[5-(4,5-dimethanoyloxy-6-methyl-oxan-2-yl)oxy-4-methanoyloxy-6-methyl-oxan-2-yl]oxy-6-[[10,13-dimethyl-14-oxidanyl-17-(5-oxidanylidene-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-methyl-oxan-4-yl] methanoate Openeye Name: [3-[5-(4,5-diformyloxy-6-methyl-tetrahydropyran-2-yl)oxy-4-formyloxy-6-methyl-tetrahydropyran-2-yl]oxy-6-[[14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-methyl-tetrahydropyran-4-yl] formate CAS Name: formic acid [3-[[5-[(4,5-diformyloxy-6-methyl-2-oxanyl)oxy]-4-formyloxy-6-methyl-2-oxanyl]oxy]-6-[[14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-methyl-4-oxanyl] ester IUPAC Name: [3-[5-(4,5-diformyloxy-6-methyloxan-2-yl)oxy-4-formyloxy-6-methyloxan-2-yl]oxy-6-[[14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-methyloxan-4-yl] formate Traditional Name: formic acid [3-[5-(4,5-diformyloxy-6-methyl-tetrahydropyran-2-yl)oxy-4-formyloxy-6-methyl-tetrahydropyran-2-yl]oxy-6-[[14-hydroxy-17-(5-keto-2H-furan-3-yl)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-2-methyl-tetrahydropyran-4-yl] ester Formula: C45H64O17 MolecularWeight: 876.97946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)OC2C(OC(CC2OC=O)OC3C(OC(CC3OC=O)OC4CCC5(C(C4)CCC6C5CCC7(C6(CCC7C8=CC(=O)OC8)O)C)C)C)C)OC=O)OC=O

Isomeric SMILES

CC1C(C(CC(O1)OC2C(OC(CC2OC=O)OC3C(OC(CC3OC=O)OC4CCC5(C(C4)CCC6C5CCC7(C6(CCC7C8=CC(=O)OC8)O)C)C)C)C)OC=O)OC=O

InChI

InChI=1S/C45H64O17/c1-24-40(56-23-49)33(53-20-46)16-38(57-24)61-42-26(3)59-39(18-35(42)55-22-48)62-41-25(2)58-37(17-34(41)54-21-47)60-29-8-11-43(4)28(15-29)6-7-32-31(43)9-12-44(5)30(10-13-45(32,44)51)27-14-36(50)52-19-27/h14,20-26,28-35,37-42,51H,6-13,15-19H2,1-5H3