lithium (2S,3S,5R)-2-hexyl-3,5-bis(oxidanyl)hexadecanoate

Systemtic Name: lithium (2S,3S,5R)-2-hexyl-3,5-bis(oxidanyl)hexadecanoate Openeye Name: lithium (2S,3S,5R)-2-hexyl-3,5-dihydroxy-hexadecanoate CAS Name: lithium (2S,3S,5R)-2-hexyl-3,5-dihydroxyhexadecanoate IUPAC Name: lithium (2S,3S,5R)-2-hexyl-3,5-dihydroxyhexadecanoate Traditional Name: lithium (2S,3S,5R)-2-hexyl-3,5-dihydroxy-palmitate Formula: C22H43LiO4 MolecularWeight: 378.51542

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CCCCCCCCCCCC(CC(C(CCCCCC)C(=O)[O-])O)O

Isomeric SMILES

[Li+].CCCCCCCCCCC[C@H](C[C@@H]([C@H](CCCCCC)C(=O)[O-])O)O

InChI

InChI=1S/C22H44O4.Li/c1-3-5-7-9-10-11-12-13-14-16-19(23)18-21(24)20(22(25)26)17-15-8-6-4-2;/h19-21,23-24H,3-18H2,1-2H3,(H,25,26);/q;+1/p-1/t19-,20+,21+;/m1./s1