[(E,2S)-2,5-bis(2,2-dimethylpropanoyloxy)-8-[(2S,3R,4R,5S,6R)-5-methoxy-6-(2-methoxyethyl)-3,4-bis(oxidanyl)oxan-2-yl]oct-3-en-6-ynyl] 2,2-dimethylpropanoate; carbon monoxide; cobalt

Systemtic Name: [(E,2S)-2,5-bis(2,2-dimethylpropanoyloxy)-8-[(2S,3R,4R,5S,6R)-5-methoxy-6-(2-methoxyethyl)-3,4-bis(oxidanyl)oxan-2-yl]oct-3-en-6-ynyl] 2,2-dimethylpropanoate; carbon monoxide; cobalt Openeye Name: carbon monoxide; cobalt; [(E,2S)-8-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-5-methoxy-6-(2-methoxyethyl)tetrahydropyran-2-yl]-2,5-bis(2,2-dimethylpropanoyloxy)oct-3-en-6-ynyl] 2,2-dimethylpropanoate CAS Name: carbon monoxide; cobalt; 2,2-dimethylpropanoic acid [(E,2S)-8-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-5-methoxy-6-(2-methoxyethyl)-2-oxanyl]-2,5-bis(2,2-dimethyl-1-oxopropoxy)oct-3-en-6-ynyl] ester IUPAC Name: carbon monoxide; cobalt; [(E,2S)-8-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-5-methoxy-6-(2-methoxyethyl)oxan-2-yl]-2,5-bis(2,2-dimethylpropanoyloxy)oct-3-en-6-ynyl] 2,2-dimethylpropanoate Traditional Name: carbon monoxide; cobalt; 2,2-dimethylpropionic acid [(E,2S)-8-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-5-methoxy-6-(2-methoxyethyl)tetrahydropyran-2-yl]-2,5-dipivaloyloxy-oct-3-en-6-ynyl] ester Formula: C38H52Co2O17 MolecularWeight: 898.67568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCC(C=CC(C#CCC1C(C(C(C(O1)CCOC)OC)O)O)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Co]

Isomeric SMILES

CC(C)(C)C(=O)OC[C@H](/C=C/C(C#CC[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CCOC)OC)O)O)OC(=O)C(C)(C)C)OC(=O)C(C)(C)C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Co]

InChI

InChI=1S/C32H52O11.6CO.2Co/c1-30(2,3)27(35)40-19-21(42-29(37)32(7,8)9)16-15-20(41-28(36)31(4,5)6)13-12-14-22-24(33)25(34)26(39-11)23(43-22)17-18-38-10;6*1-2;;/h15-16,20-26,33-34H,14,17-19H2,1-11H3;;;;;;;;/b16-15+;;;;;;;;/t20?,21-,22-,23+,24-,25+,26+;;;;;;;;/m0......../s1