cyclohexylazanium; phosphono (3S,4R)-3,4,5-tris(oxidanyl)pentanoate

Systemtic Name: cyclohexylazanium; phosphono (3S,4R)-3,4,5-tris(oxidanyl)pentanoate Openeye Name: cyclohexylammonium; phosphono (3S,4R)-3,4,5-trihydroxypentanoate CAS Name: cyclohexylammonium; (3S,4R)-3,4,5-trihydroxypentanoic acid phosphono ester IUPAC Name: cyclohexylazanium; phosphono (3S,4R)-3,4,5-trihydroxypentanoate Traditional Name: cyclohexylammonium; (3S,4R)-3,4,5-trihydroxyvaleric acid phosphono ester Formula: C17H39N2O8P+2 MolecularWeight: 430.473921

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH3+].C1CCC(CC1)[NH3+].C(C(C(CO)O)O)C(=O)OP(=O)(O)O

Isomeric SMILES

C1CCC(CC1)[NH3+].C1CCC(CC1)[NH3+].C([C@@H]([C@@H](CO)O)O)C(=O)OP(=O)(O)O

InChI

InChI=1S/2C6H13N.C5H11O8P/c2*7-6-4-2-1-3-5-6;6-2-4(8)3(7)1-5(9)13-14(10,11)12/h2*6H,1-5,7H2;3-4,6-8H,1-2H2,(H2,10,11,12)/p+2/t;;3-,4+/m..0/s1