1-(3'-Amino-3'-carboxypropyl)uracil
Completing data — refresh the page later to see the latest
Basic information
- CAS
69557-82-0- Standard SMILES
N[C@@H](CCn1ccc(=O)[nH]c1=O)C(=O)O- InChIKey
JRUDOTYRCSMXFT-YFKPBYRVSA-N- Molecular formula
- C8H11N3O4
- Average molar mass
- 213.19 g/mol
- Monoisotopic mass
- 213.07495584
Overview
structure given in first source; RN given is for (S)-isomer
Names & identifiers
- Preferred name
- 1-(3'-Amino-3'-carboxypropyl)uracil
- IUPAC
- (2S)-2-amino-4-(2,4-dioxopyrimidin-1-yl)butanoic acid
- English name
- 1-(3'-amino-3'-carboxypropyl)uracil
- Molecular weight
- 0
Names & synonyms
1-Acpu69557-82-01-(3'-Amino-3'-carboxypropyl)uracilRefChem:74217(S)-2-Amino-4-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)butanoic acid(2S)-2-amino-4-(2,4-dioxopyrimidin-1-yl)butanoic acidDTXSID309895912-Amino-4-(4-hydroxy-2-oxopyrimidin-1(2H)-yl)butanoic acid(2S)-2-Amino-4-(4-hydroxy-2-oxopyrimidin-1(2H)-yl)butanoic acid(S)-2-Amino-4-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)butanoicacid1(2H)-Pyrimidinebutanoic acid, alpha-amino-3,4-dihydro-2,4-dioxo-, (S)-
Database identifiers
- CAS
69557-82-0- PubChem CID
- 129661
- DTXSID
DTXSID30989591
Properties
Computed structural propertiesFilling in
- XLogP
- -4
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 326
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…