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Reference substances

Reference substances

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General information

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Reference substance information

IUPAC name:
isomers of disodium amino-(3-carboxylatopropanamido)hexanoate

Molecular and structural information

Molecular formula:
C10H16N2Na2O5
Molecular weight:
290.225
SMILES notation:
[Na+].[Na+].[O-]C(=O)C(N)CCCCNC(=O)CCC([O-])=O
[Na+].[Na+].[O-]C(=O)C(CCCCN)NC(=O)CCC([O-])=O
InChl:
InChI=1S/C10H18N2O5.Na/c11-7(10(16)17)3-1-2-6-12-8(13)4-5-9(14)15;/h7H,1-6,11H2,(H,12,13)(H,14,15)(H,16,17);/q;+1/p-2
InChI=1S/C10H18N2O5.2Na/c11-6-2-1-3-7(10(16)17)12-8(13)4-5-9(14)15;;/h7H,1-6,11H2,(H,12,13)(H,14,15)(H,16,17);;/q;2*+1/p-2
Structural formula:
Chemical structure