2-(hydroxymethyl)-4-(14-methylpentadecanoyl)-5-oxidanyl-furan-3-one

Systemtic Name: 2-(hydroxymethyl)-4-(14-methylpentadecanoyl)-5-oxidanyl-furan-3-one Openeye Name: 5-hydroxy-2-(hydroxymethyl)-4-(14-methylpentadecanoyl)furan-3-one CAS Name: 5-hydroxy-2-(hydroxymethyl)-4-(14-methyl-1-oxopentadecyl)-3-furanone IUPAC Name: 5-hydroxy-2-(hydroxymethyl)-4-(14-methylpentadecanoyl)furan-3-one Traditional Name: 5-hydroxy-2-methylol-4-(14-methylpentadecanoyl)furan-3-one Formula: C21H36O5 MolecularWeight: 368.50754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCC(=O)C1=C(OC(C1=O)CO)O

Isomeric SMILES

CC(C)CCCCCCCCCCCCC(=O)C1=C(OC(C1=O)CO)O

InChI

InChI=1S/C21H36O5/c1-16(2)13-11-9-7-5-3-4-6-8-10-12-14-17(23)19-20(24)18(15-22)26-21(19)25/h16,18,22,25H,3-15H2,1-2H3