(2R)-2-[(2S)-1-oxidanidyl-12-[(2R)-4-oxidanidyl-2-oxidanyl-4-oxidanylidene-butanoyl]oxy-1-oxidanylidene-dodecan-2-yl]-5-oxidanylidene-oxolane-2-carboxylate

Systemtic Name: (2R)-2-[(2S)-1-oxidanidyl-12-[(2R)-4-oxidanidyl-2-oxidanyl-4-oxidanylidene-butanoyl]oxy-1-oxidanylidene-dodecan-2-yl]-5-oxidanylidene-oxolane-2-carboxylate Openeye Name: (2R)-2-[(1S)-1-carboxylato-11-[(2R)-2-hydroxy-4-oxido-4-oxo-butanoyl]oxy-undecyl]-5-oxo-tetrahydrofuran-2-carboxylate CAS Name: (2R)-2-[(2S)-12-[(2R)-2-hydroxy-4-oxido-1,4-dioxobutoxy]-1-oxido-1-oxododecan-2-yl]-5-oxo-2-oxolanecarboxylate IUPAC Name: (2R)-2-[(2S)-12-[(2R)-2-hydroxy-4-oxido-4-oxobutanoyl]oxy-1-oxido-1-oxododecan-2-yl]-5-oxooxolane-2-carboxylate Traditional Name: (2R)-2-[(1S)-1-carboxylato-11-[(2R)-2-hydroxy-4-keto-4-oxido-butanoyl]oxy-undecyl]-5-keto-tetrahydrofuran-2-carboxylate Formula: C21H29O11-3 MolecularWeight: 457.44836

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1=O)(C(CCCCCCCCCCOC(=O)C(CC(=O)[O-])O)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1C[C@@](OC1=O)([C@H](CCCCCCCCCCOC(=O)[C@@H](CC(=O)[O-])O)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C21H32O11/c22-15(13-16(23)24)19(28)31-12-8-6-4-2-1-3-5-7-9-14(18(26)27)21(20(29)30)11-10-17(25)32-21/h14-15,22H,1-13H2,(H,23,24)(H,26,27)(H,29,30)/p-3/t14-,15-,21-/m1/s1