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

Systemtic Name: [3,4,5-tris(oxidanyl)-6-propoxy-oxan-2-yl]methyl octadecanoate Openeye Name: (3,4,5-trihydroxy-6-propoxy-tetrahydropyran-2-yl)methyl octadecanoate CAS Name: octadecanoic acid (3,4,5-trihydroxy-6-propoxy-2-oxanyl)methyl ester IUPAC Name: (3,4,5-trihydroxy-6-propoxyoxan-2-yl)methyl octadecanoate Traditional Name: stearic acid (3,4,5-trihydroxy-6-propoxy-tetrahydropyran-2-yl)methyl ester Formula: C27H52O7 MolecularWeight: 488.69758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)OCCC)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)OCCC)O)O)O

InChI

InChI=1S/C27H52O7/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(28)33-21-22-24(29)25(30)26(31)27(34-22)32-20-4-2/h22,24-27,29-31H,3-21H2,1-2H3