[3,4-diacetyloxy-5-(hexadecanoylamino)-6-prop-2-enoxy-oxan-2-yl]methyl ethanoate

Systemtic Name: [3,4-diacetyloxy-5-(hexadecanoylamino)-6-prop-2-enoxy-oxan-2-yl]methyl ethanoate Openeye Name: [3,4-diacetoxy-6-allyloxy-5-(hexadecanoylamino)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [3,4-diacetyloxy-5-(1-oxohexadecylamino)-6-prop-2-enoxy-2-oxanyl]methyl ester IUPAC Name: [3,4-diacetyloxy-5-(hexadecanoylamino)-6-prop-2-enoxyoxan-2-yl]methyl acetate Traditional Name: acetic acid (3,4-diacetoxy-6-allyloxy-5-palmitamido-tetrahydropyran-2-yl)methyl ester Formula: C31H53NO9 MolecularWeight: 583.75382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1C(C(C(OC1OCC=C)COC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1C(C(C(OC1OCC=C)COC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C31H53NO9/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-27(36)32-28-30(40-25(5)35)29(39-24(4)34)26(22-38-23(3)33)41-31(28)37-21-7-2/h7,26,28-31H,2,6,8-22H2,1,3-5H3,(H,32,36)