[(3S)-3-methyl-3,4-bis(oxidanyl)butyl] phosphono hydrogen phosphate bromide

Systemtic Name: [(3S)-3-methyl-3,4-bis(oxidanyl)butyl] phosphono hydrogen phosphate bromide Openeye Name: [(3S)-3,4-dihydroxy-3-methyl-butyl] phosphono hydrogen phosphate bromide CAS Name: [(3S)-3,4-dihydroxy-3-methylbutyl] phosphono hydrogen phosphate bromide IUPAC Name: [(3S)-3,4-dihydroxy-3-methylbutyl] phosphono hydrogen phosphate bromide Traditional Name: [(3S)-3,4-dihydroxy-3-methyl-butyl] phosphono hydrogen phosphate bromide Formula: C5H14BrO9P2- MolecularWeight: 360.010782

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOP(=O)(O)OP(=O)(O)O)(CO)O.[Br-]

Isomeric SMILES

C[C@](CCOP(=O)(O)OP(=O)(O)O)(CO)O.[Br-]

InChI

InChI=1S/C5H14O9P2.BrH/c1-5(7,4-6)2-3-13-16(11,12)14-15(8,9)10;/h6-7H,2-4H2,1H3,(H,11,12)(H2,8,9,10);1H/p-1/t5-;/m0./s1