sodium 5-(hydroxymethyl)-3-(14-methylhexadecanoyl)-4-oxidanyl-3H-furan-2-one

Systemtic Name: sodium 5-(hydroxymethyl)-3-(14-methylhexadecanoyl)-4-oxidanyl-3H-furan-2-one Openeye Name: sodium 4-hydroxy-5-(hydroxymethyl)-3-(14-methylhexadecanoyl)-3H-furan-2-one CAS Name: sodium 4-hydroxy-5-(hydroxymethyl)-3-(14-methyl-1-oxohexadecyl)-3H-furan-2-one IUPAC Name: sodium 4-hydroxy-5-(hydroxymethyl)-3-(14-methylhexadecanoyl)-3H-furan-2-one Traditional Name: sodium 4-hydroxy-3-(14-methylhexadecanoyl)-5-methylol-3H-furan-2-one Formula: C22H38NaO5+ MolecularWeight: 405.52389

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCCCCCCCCCCC(=O)C1C(=C(OC1=O)CO)O.[Na+]

Isomeric SMILES

CCC(C)CCCCCCCCCCCCC(=O)C1C(=C(OC1=O)CO)O.[Na+]

InChI

InChI=1S/C22H38O5.Na/c1-3-17(2)14-12-10-8-6-4-5-7-9-11-13-15-18(24)20-21(25)19(16-23)27-22(20)26;/h17,20,23,25H,3-16H2,1-2H3;/q;+1