3-Pentenoic acid, 2-amino-4-methyl-5-phosphono-, (2R,3E)-
Basic information
- CAS
116049-53-7- Standard SMILES
C/C(=C\[C@@H](N)C(=O)O)CP(=O)(O)O- InChIKey
BDYHNCZIGYIOGJ-XWCPEMDWSA-N- Molecular formula
- C6H12NO5P
- Average molar mass
- 209.14 g/mol
- Monoisotopic mass
- 209.04530948
Names & identifiers
- Preferred name
- 3-Pentenoic acid, 2-amino-4-methyl-5-phosphono-, (2R,3E)-
- IUPAC
- (E,2R)-2-amino-4-methyl-5-phosphonopent-3-enoic acid
Names & synonyms
Cgp 40116CGP-40116N6DQ6GSX9G3-Pentenoic acid, 2-amino-4-methyl-5-phosphono-, (2R,3E)-116049-53-7UNII-N6DQ6GSX9GCGP-37849, (R)-CGP-40117, (R)-3-Pentenoic acid, 2-amino-4-methyl-5-phosphono-, (R-(E))-Tocris-1469cgp40116SCHEMBL9744193
Show more names
(2R,3E)-2-Amino-4-methyl-5-phosphono-3-pentenoic acid(2R,3E)-2-amino-4-methyl-5-phosphonopent-3-enoic acidDTXSID901214124NCGC00025174-01NCGC00025174-02PD132789
Database identifiers
- CAS
116049-53-7- PubChem CID
- 6604869
- DTXSID
DTXSID901214124- ChEMBL
CHEMBL189477- UNII
- N6DQ6GSX9G
- Nikkaji
- J340.696B
Properties
Computed structural properties
- XLogP
- -4.1
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 268
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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