carbon monoxide; cobalt; [(3S,6R)-6-[3-[(2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[3,3-bis(ethylsulfanyl)propyl]oxan-2-yl]prop-1-ynyl]-3,6-dihydro-2H-pyran-3-yl] 2,2-dimethylpropanoate

Systemtic Name: carbon monoxide; cobalt; [(3S,6R)-6-[3-[(2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[3,3-bis(ethylsulfanyl)propyl]oxan-2-yl]prop-1-ynyl]-3,6-dihydro-2H-pyran-3-yl] 2,2-dimethylpropanoate Openeye Name: carbon monoxide; cobalt; [(3S,6R)-6-[3-[(2S,3S,4S,5R,6R)-3,4,5-triacetoxy-6-[3,3-bis(ethylsulfanyl)propyl]tetrahydropyran-2-yl]prop-1-ynyl]-3,6-dihydro-2H-pyran-3-yl] 2,2-dimethylpropanoate CAS Name: carbon monoxide; cobalt; 2,2-dimethylpropanoic acid [(3S,6R)-6-[3-[(2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[3,3-bis(ethylthio)propyl]-2-oxanyl]prop-1-ynyl]-3,6-dihydro-2H-pyran-3-yl] ester IUPAC Name: carbon monoxide; cobalt; [(3S,6R)-6-[3-[(2S,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-[3,3-bis(ethylsulfanyl)propyl]oxan-2-yl]prop-1-ynyl]-3,6-dihydro-2H-pyran-3-yl] 2,2-dimethylpropanoate Traditional Name: carbon monoxide; cobalt; 2,2-dimethylpropionic acid [(3S,6R)-6-[3-[(2S,3S,4S,5R,6R)-3,4,5-triacetoxy-6-[3,3-bis(ethylthio)propyl]tetrahydropyran-2-yl]prop-1-ynyl]-3,6-dihydro-2H-pyran-3-yl] ester Formula: C37H46Co2O16S2 MolecularWeight: 928.74794

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(CCC1C(C(C(C(O1)CC#CC2C=CC(CO2)OC(=O)C(C)(C)C)OC(=O)C)OC(=O)C)OC(=O)C)SCC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Co]

Isomeric SMILES

CCSC(CC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)CC#C[C@H]2C=C[C@@H](CO2)OC(=O)C(C)(C)C)OC(=O)C)OC(=O)C)OC(=O)C)SCC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co].[Co]

InChI

InChI=1S/C31H46O10S2.6CO.2Co/c1-9-42-26(43-10-2)17-16-25-28(38-20(4)33)29(39-21(5)34)27(37-19(3)32)24(41-25)13-11-12-22-14-15-23(18-36-22)40-30(35)31(6,7)8;6*1-2;;/h14-15,22-29H,9-10,13,16-18H2,1-8H3;;;;;;;;/t22-,23-,24-,25+,27-,28+,29+;;;;;;;;/m0......../s1