TU3Wwz9wcy

HCID 71445238

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Basic information

CAS: 927869-49-6
Standard SMILES: CC(C)[C@H](N=CCCCC=N[C@H](C(=O)O)C(C)C)C(=O)O
InChIKey: WWNCAYVJSBATJU-STQMWFEESA-N
Molecular formula: C15H26N2O4
Average molar mass: 298.38 g/mol
Monoisotopic mass: 298.18925731

Names & identifiers

Preferred name: TU3Wwz9wcy
IUPAC: (2S)-2-[5-[(1S)-1-carboxy-2-methylpropyl]iminopentylideneamino]-3-methylbutanoic acid

Names & synonyms

TU3WWZ9WCY927869-49-6DTXSID10853807GLUTARAL, (VALINE-VALINE LINKER)-(2S,2'S)-2,2'-((PENTANE-1,5-DIYLIDENE)BIS(AZANEYLYLIDENE))BIS(3-METHYLBUTANOIC ACID)(2S,2'S)-2,2'-{(1E,5E)-Pentane-1,5-diylidenebis[(E)-azanylylidene]}bis(3-methylbutanoic acid)(2S,2'S)-2,2'-{(1E,5E)-Pentane-1,5-diylidenebis[(E)azanylylidene]}bis(3-methylbutanoic acid)

Database identifiers

CAS: 927869-49-6
PubChem CID: 71445238
DTXSID: DTXSID10853807
UNII: TU3WWZ9WCY

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 99.3 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 10
Heavy atoms: 21
Formal charge: 0
Complexity: 353

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