O1-tert-butyl O4a-methyl (4S,4aS,8aS)-4-[5-(1,3-dioxan-2-yl)pent-4-ynyl]-3-methyl-2,5-bis(oxidanylidene)-3,4,6,7,8,8a-hexahydro-1H-naphthalene-1,4a-dicarboxylate

Systemtic Name: O1-tert-butyl O4a-methyl (4S,4aS,8aS)-4-[5-(1,3-dioxan-2-yl)pent-4-ynyl]-3-methyl-2,5-bis(oxidanylidene)-3,4,6,7,8,8a-hexahydro-1H-naphthalene-1,4a-dicarboxylate Openeye Name: O1-tert-butyl O4a-methyl (4S,4aS,8aS)-4-[5-(1,3-dioxan-2-yl)pent-4-ynyl]-3-methyl-2,5-dioxo-decalin-1,4a-dicarboxylate CAS Name: (4S,4aS,8aS)-4-[5-(1,3-dioxan-2-yl)pent-4-ynyl]-3-methyl-2,5-dioxo-3,4,6,7,8,8a-hexahydro-1H-naphthalene-1,4a-dicarboxylic acid O1-tert-butyl ester O4a-methyl ester IUPAC Name: 1-O-tert-butyl 4a-O-methyl (4S,4aS,8aS)-4-[5-(1,3-dioxan-2-yl)pent-4-ynyl]-3-methyl-2,5-dioxo-3,4,6,7,8,8a-hexahydro-1H-naphthalene-1,4a-dicarboxylate Traditional Name: (4S,4aS,8aS)-4-[5-(1,3-dioxan-2-yl)pent-4-ynyl]-2,5-diketo-3-methyl-decalin-1,4a-dicarboxylic acid O1-tert-butyl ester O4a-methyl ester Formula: C27H38O8 MolecularWeight: 490.58582

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2(C(CCCC2=O)C(C1=O)C(=O)OC(C)(C)C)C(=O)OC)CCCC#CC3OCCCO3

Isomeric SMILES

CC1[C@@H]([C@@]2([C@@H](CCCC2=O)C(C1=O)C(=O)OC(C)(C)C)C(=O)OC)CCCC#CC3OCCCO3

InChI

InChI=1S/C27H38O8/c1-17-18(11-7-6-8-14-21-33-15-10-16-34-21)27(25(31)32-5)19(12-9-13-20(27)28)22(23(17)29)24(30)35-26(2,3)4/h17-19,21-22H,6-7,9-13,15-16H2,1-5H3/t17?,18-,19-,22?,27-/m0/s1