butanoic acid; 2-(hydroxymethyl)piperidine-3,4,5-triol

Systemtic Name: butanoic acid; 2-(hydroxymethyl)piperidine-3,4,5-triol Openeye Name: butyric acid; 2-(hydroxymethyl)piperidine-3,4,5-triol CAS Name: butanoic acid; 2-(hydroxymethyl)piperidine-3,4,5-triol IUPAC Name: butanoic acid; 2-(hydroxymethyl)piperidine-3,4,5-triol Traditional Name: butyric acid; 2-methylolpiperidine-3,4,5-triol Formula: C22H45NO12 MolecularWeight: 515.5922

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)O.CCCC(=O)O.CCCC(=O)O.CCCC(=O)O.C1C(C(C(C(N1)CO)O)O)O

Isomeric SMILES

CCCC(=O)O.CCCC(=O)O.CCCC(=O)O.CCCC(=O)O.C1C(C(C(C(N1)CO)O)O)O

InChI

InChI=1S/C6H13NO4.4C4H8O2/c8-2-3-5(10)6(11)4(9)1-7-3;4*1-2-3-4(5)6/h3-11H,1-2H2;4*2-3H2,1H3,(H,5,6)