[2-[1-(3,4-dimethoxy-6-methyl-5-oxidanyl-oxan-2-yl)oxypropan-2-yl]-12-[4,6-dimethyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-3,5,7,9,11,13-hexamethyl-10-(6-methyl-3-oxidanyl-4-oxidanylidene-oxan-2-yl)oxy-7-oxidanyl-6,14-bis(oxidanylidene)-1-oxacyclotetradec-4-yl] 3-methyl-2-oxidanyl-butanoate

Systemtic Name: [2-[1-(3,4-dimethoxy-6-methyl-5-oxidanyl-oxan-2-yl)oxypropan-2-yl]-12-[4,6-dimethyl-4,5-bis(oxidanyl)oxan-2-yl]oxy-3,5,7,9,11,13-hexamethyl-10-(6-methyl-3-oxidanyl-4-oxidanylidene-oxan-2-yl)oxy-7-oxidanyl-6,14-bis(oxidanylidene)-1-oxacyclotetradec-4-yl] 3-methyl-2-oxidanyl-butanoate Openeye Name: [12-(4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-7-hydroxy-2-[2-(5-hydroxy-3,4-dimethoxy-6-methyl-tetrahydropyran-2-yl)oxy-1-methyl-ethyl]-10-(3-hydroxy-6-methyl-4-oxo-tetrahydropyran-2-yl)oxy-3,5,7,9,11,13-hexamethyl-6,14-dioxo-oxacyclotetradec-4-yl] 2-hydroxy-3-methyl-butanoate CAS Name: 2-hydroxy-3-methylbutanoic acid [12-[(4,5-dihydroxy-4,6-dimethyl-2-oxanyl)oxy]-7-hydroxy-2-[1-[(5-hydroxy-3,4-dimethoxy-6-methyl-2-oxanyl)oxy]propan-2-yl]-10-[(3-hydroxy-6-methyl-4-oxo-2-oxanyl)oxy]-3,5,7,9,11,13-hexamethyl-6,14-dioxo-oxacyclotetradec-4-yl] ester IUPAC Name: [12-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-7-hydroxy-2-[1-(5-hydroxy-3,4-dimethoxy-6-methyloxan-2-yl)oxypropan-2-yl]-10-(3-hydroxy-6-methyl-4-oxooxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-6,14-dioxo-oxacyclotetradec-4-yl] 2-hydroxy-3-methylbutanoate Traditional Name: 2-hydroxy-3-methyl-butyric acid [12-(4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl)oxy-7-hydroxy-2-[2-(5-hydroxy-3,4-dimethoxy-6-methyl-tetrahydropyran-2-yl)oxy-1-methyl-ethyl]-10-(3-hydroxy-4-keto-6-methyl-tetrahydropyran-2-yl)oxy-6,14-diketo-3,5,7,9,11,13-hexamethyl-oxacyclotetradec-4-yl] ester Formula: C48H82O20 MolecularWeight: 979.15268

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(C(O1)OC2C(CC(C(=O)C(C(C(C(OC(=O)C(C(C2C)OC3CC(C(C(O3)C)O)(C)O)C)C(C)COC4C(C(C(C(O4)C)O)OC)OC)C)OC(=O)C(C(C)C)O)C)(C)O)C)O

Isomeric SMILES

CC1CC(=O)C(C(O1)OC2C(CC(C(=O)C(C(C(C(OC(=O)C(C(C2C)OC3CC(C(C(O3)C)O)(C)O)C)C(C)COC4C(C(C(C(O4)C)O)OC)OC)C)OC(=O)C(C(C)C)O)C)(C)O)C)O

InChI

InChI=1S/C48H82O20/c1-20(2)32(50)44(56)67-37-25(7)36(22(4)19-61-46-40(60-15)39(59-14)33(51)28(10)64-46)66-43(55)27(9)38(65-31-18-48(13,58)42(54)29(11)63-31)24(6)35(21(3)17-47(12,57)41(53)26(37)8)68-45-34(52)30(49)16-23(5)62-45/h20-29,31-40,42,45-46,50-52,54,57-58H,16-19H2,1-15H3