[6-methoxy-3,4,5-tris(oxidanyl)oxan-2-yl]methyl nonanoate

Systemtic Name: [6-methoxy-3,4,5-tris(oxidanyl)oxan-2-yl]methyl nonanoate Openeye Name: (3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl)methyl nonanoate CAS Name: nonanoic acid (3,4,5-trihydroxy-6-methoxy-2-oxanyl)methyl ester IUPAC Name: (3,4,5-trihydroxy-6-methoxyoxan-2-yl)methyl nonanoate Traditional Name: pelargonic acid (3,4,5-trihydroxy-6-methoxy-tetrahydropyran-2-yl)methyl ester Formula: C16H30O7 MolecularWeight: 334.4052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OCC1C(C(C(C(O1)OC)O)O)O

Isomeric SMILES

CCCCCCCCC(=O)OCC1C(C(C(C(O1)OC)O)O)O

InChI

InChI=1S/C16H30O7/c1-3-4-5-6-7-8-9-12(17)22-10-11-13(18)14(19)15(20)16(21-2)23-11/h11,13-16,18-20H,3-10H2,1-2H3