2-azanyl-3-(1H-imidazol-5-yl)propanoic acid; 2-(hydroxymethyl)-6-[2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-oxane-3,4,5-triol; propane-1,2,3-triol

Systemtic Name: 2-azanyl-3-(1H-imidazol-5-yl)propanoic acid; 2-(hydroxymethyl)-6-[2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-oxane-3,4,5-triol; propane-1,2,3-triol Openeye Name: 2-amino-3-(1H-imidazol-5-yl)propanoic acid; glycerol; 2-(hydroxymethyl)-6-[4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-tetrahydropyran-3,4,5-triol CAS Name: 2-amino-3-(1H-imidazol-5-yl)propanoic acid; 2-(hydroxymethyl)-6-[[4,5,6-trihydroxy-2-(hydroxymethyl)-3-oxanyl]oxy]oxane-3,4,5-triol; propane-1,2,3-triol IUPAC Name: 2-amino-3-(1H-imidazol-5-yl)propanoic acid; 2-(hydroxymethyl)-6-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol; propane-1,2,3-triol Traditional Name: 2-amino-3-(1H-imidazol-5-yl)propionic acid; glycerol; 2-methylol-6-(4,5,6-trihydroxy-2-methylol-tetrahydropyran-3-yl)oxy-tetrahydropyran-3,4,5-triol Formula: C21H39N3O16 MolecularWeight: 589.54486

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CC(C(=O)O)N.C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O.C(C(CO)O)O

Isomeric SMILES

C1=C(NC=N1)CC(C(=O)O)N.C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O.C(C(CO)O)O

InChI

InChI=1S/C12H22O11.C6H9N3O2.C3H8O3/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17;7-5(6(10)11)1-4-2-8-3-9-4;4-1-3(6)2-5/h3-20H,1-2H2;2-3,5H,1,7H2,(H,8,9)(H,10,11);3-6H,1-2H2