pentane-1,5-diamine; phosphonomethylphosphonic acid

Systemtic Name: pentane-1,5-diamine; phosphonomethylphosphonic acid Openeye Name: pentane-1,5-diamine; phosphonomethylphosphonic acid CAS Name: pentane-1,5-diamine; phosphonomethylphosphonic acid IUPAC Name: pentane-1,5-diamine; phosphonomethylphosphonic acid Traditional Name: cadaverine; phosphonomethylphosphonic acid Formula: C9H38N2O24P8 MolecularWeight: 806.187108

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Descriptors Computed from Structure

Canonical SMILES:

C(CCN)CCN.C(P(=O)(O)O)P(=O)(O)O.C(P(=O)(O)O)P(=O)(O)O.C(P(=O)(O)O)P(=O)(O)O.C(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C(CCN)CCN.C(P(=O)(O)O)P(=O)(O)O.C(P(=O)(O)O)P(=O)(O)O.C(P(=O)(O)O)P(=O)(O)O.C(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C5H14N2.4CH6O6P2/c6-4-2-1-3-5-7;4*2-8(3,4)1-9(5,6)7/h1-7H2;4*1H2,(H2,2,3,4)(H2,5,6,7)