2-(hydroxymethyl)-6-octoxy-oxane-3,4,5-triol hydrate

Systemtic Name: 2-(hydroxymethyl)-6-octoxy-oxane-3,4,5-triol hydrate Openeye Name: 2-(hydroxymethyl)-6-octoxy-tetrahydropyran-3,4,5-triol hydrate CAS Name: 2-(hydroxymethyl)-6-octoxyoxane-3,4,5-triol hydrate IUPAC Name: 2-(hydroxymethyl)-6-octoxyoxane-3,4,5-triol hydrate Traditional Name: 2-methylol-6-octoxy-tetrahydropyran-3,4,5-triol hydrate Formula: C14H30O7 MolecularWeight: 310.3838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1C(C(C(C(O1)CO)O)O)O.O

Isomeric SMILES

CCCCCCCCOC1C(C(C(C(O1)CO)O)O)O.O

InChI

InChI=1S/C14H28O6.H2O/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14;/h10-18H,2-9H2,1H3;1H2