Basic information
- Standard SMILES
COc1cc(C(=N)NO)cc(C)c1OC[C@@H](O)CNC(=O)CO- InChIKey
OKWRCLKUWFGTMD-JTQLQIEISA-N- Molecular formula
- C14H21N3O6
- Average molar mass
- 327.33 g/mol
- Monoisotopic mass
- 327.1430354
Names & identifiers
- Preferred name
- (S)-2-Hydroxy-N-(2-hydroxy-3-[4-(N-hydroxycarbamimidoyl)-2-methoxy-6-methyl-phenoxy]-propyl)-acetamide
- IUPAC
- 2-hydroxy-N-[(2S)-2-hydroxy-3-[4-(N'-hydroxycarbamimidoyl)-2-methoxy-6-methylphenoxy]propyl]acetamide
Names & synonyms
SCHEMBL1175344OKWRCLKUWFGTMD-JTQLQIEISA-N(S)-2-Hydroxy-N-(2-hydroxy-3-[4-(N-hydroxycarbamimidoyl)-2-methoxy-6-methyl-phenoxy]-propyl)-acetamide
Database identifiers
- PubChem CID
- 86645303
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 147 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 406
Related reactions
5 records
Compound notes
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