Basic information
- CAS
105831-46-7- Standard SMILES
O=C(C[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)NO- InChIKey
CFSPUGCLPSUAHO-SJORKVTESA-N- Molecular formula
- C20H22N2O5
- Average molar mass
- 370.4 g/mol
- Monoisotopic mass
- 370.1528718
Names & identifiers
- Preferred name
- 3-(N-hydroxycarboxamido-2-benzylpropanoyl)phenylalanine
- IUPAC
- (2S)-2-[[(2R)-2-benzyl-4-(hydroxyamino)-4-oxobutanoyl]amino]-3-phenylpropanoic acid
- English name
- 3-(N-hydroxycarboxamido-2-benzylpropanoyl)phenylalanine
- Molecular formula
- C20H22N2O5
- Molecular weight
- 370.4
Names & synonyms
RB 38A105831-46-73-(N-Hydroxycarboxamido-2-benzylpropanoyl)phenylalanineRB-38 ARefChem:92702RB 38 ADTXSID70909758N-[2-Benzyl-1,4-dihydroxy-4-(hydroxyimino)butylidene]phenylalanineL-Phenylalanine, N-(4-(hydroxyamino)-1,4-dioxo-2-(phenylmethyl)butyl)-, (R)-N-[(2R)-2-Benzyl-1,4-dihydroxy-4-(hydroxyimino)butylidene]-L-phenylalanineRB-38AN-[(2R)-3-(Hydroxyaminocarbonyl)-2-benzylpropionyl]-L-Phe-OH
Show more names
N-[(R)-4-(Hydroxyamino)-1,4-dioxo-2-(phenylmethyl)butyl]-L-phenylalanine
Database identifiers
- CAS
105831-46-7- PubChem CID
- 129130
- DTXSID
DTXSID70909758- Nikkaji
- J246.400D
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 499
Physicochemical properties
- Density
- 1.292 · 1.292±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 3.562 · 3.562±0.10(predicted)
Chemistry & industry
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…