methyl 9-[[(4aR,6R,7R,8R,8aS)-7-acetamido-2,2-dimethyl-8-oxidanyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]nonanoate

Systemtic Name: methyl 9-[[(4aR,6R,7R,8R,8aS)-7-acetamido-2,2-dimethyl-8-oxidanyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]nonanoate Openeye Name: methyl 9-[[(4aR,6R,7R,8R,8aS)-7-acetamido-8-hydroxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]nonanoate CAS Name: 9-[[(4aR,6R,7R,8R,8aS)-7-acetamido-8-hydroxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]nonanoic acid methyl ester IUPAC Name: methyl 9-[[(4aR,6R,7R,8R,8aS)-7-acetamido-8-hydroxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]nonanoate Traditional Name: 9-[[(4aR,6R,7R,8R,8aS)-7-acetamido-8-hydroxy-2,2-dimethyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]pelargonic acid methyl ester Formula: C21H37NO8 MolecularWeight: 431.52038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(C2C(COC(O2)(C)C)OC1OCCCCCCCCC(=O)OC)O

Isomeric SMILES

CC(=O)N[C@@H]1[C@H]([C@H]2[C@@H](COC(O2)(C)C)O[C@H]1OCCCCCCCCC(=O)OC)O

InChI

InChI=1S/C21H37NO8/c1-14(23)22-17-18(25)19-15(13-28-21(2,3)30-19)29-20(17)27-12-10-8-6-5-7-9-11-16(24)26-4/h15,17-20,25H,5-13H2,1-4H3,(H,22,23)/t15-,17-,18-,19-,20-/m1/s1