2,6-bis(azanyl)hexanoic acid; 2-(hydroxymethyl)-6-[2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-oxane-3,4,5-triol

Systemtic Name: 2,6-bis(azanyl)hexanoic acid; 2-(hydroxymethyl)-6-[2-(hydroxymethyl)-4,5,6-tris(oxidanyl)oxan-3-yl]oxy-oxane-3,4,5-triol Openeye Name: 2,6-diaminohexanoic acid; 2-(hydroxymethyl)-6-[4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-tetrahydropyran-3,4,5-triol CAS Name: 2,6-diaminohexanoic acid; 2-(hydroxymethyl)-6-[[4,5,6-trihydroxy-2-(hydroxymethyl)-3-oxanyl]oxy]oxane-3,4,5-triol IUPAC Name: 2,6-diaminohexanoic acid; 2-(hydroxymethyl)-6-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol Traditional Name: 2,6-diaminohexanoic acid; 2-methylol-6-(4,5,6-trihydroxy-2-methylol-tetrahydropyran-3-yl)oxy-tetrahydropyran-3,4,5-triol Formula: C18H36N2O13 MolecularWeight: 488.48404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CCN)CC(C(=O)O)N.C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O

Isomeric SMILES

C(CCN)CC(C(=O)O)N.C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O

InChI

InChI=1S/C12H22O11.C6H14N2O2/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;7-4-2-1-3-5(8)6(9)10/h3-20H,1-2H2;5H,1-4,7-8H2,(H,9,10)