Molecule

β-hydroxyasparagine

AlkaPlorer ID: AK062357

Synonym: None

IUPAC Name: (2S,3S)-2,4-diamino-3-hydroxy-4-oxobutanoic acid

SMILES: N=C(O)[C@@H](O)[C@H](N)C(=O)O

InChI: InChI=1S/C4H8N2O4/c5-1(4(9)10)2(7)3(6)8/h1-2,7H,5H2,(H2,6,8)(H,9,10)/t1-,2-/m0/s1

InChIKey: VQTLPSCRBFYDNX-LWMBPPNESA-N

PubChem CID: 46878457

CAS: 16712-79-1

SuperNatural Ⅲ: SN0397572-02

NPASS: NPC283312

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Krameria sonorae	Krameria	Krameriaceae	Zygophyllales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Ophiopogon japonicus	Ophiopogon	Asparagaceae	Asparagales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Arthrinium phaeospermum	Arthrinium	Apiosporaceae	Xylariales	Sordariomycetes	Ascomycota	Fungi	Eukaryota
Sarcodon leucopus	Sarcodon	Thelephoraceae	Thelephorales	Agaricomycetes	Basidiomycota	Fungi	Eukaryota
Peridinium balticum	Peridinium	Peridiniaceae	Peridiniales	Dinophyceae	None	None	Eukaryota
Polyangium fumosum	Polyangium	Polyangiaceae	Polyangiales	None	Myxococcota	None	Bacteria
Parkia bicolor	Parkia	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Salvia argentea	Salvia	Lamiaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Penstemon cyathophorus	Penstemon	Plantaginaceae	Lamiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 148.118

TPSA？: 127.63

MolLogP？: -1.7055300000000004

Number of H-Donors: 5

Number of H-Acceptors: 4

RingCount: 0

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi

AKRT ID	Reaction	Reaction Link ID
AKRT016975	NC(=O)C[C@H](N)C(=O)O>>NC(=O)[C@@H](O)[C@H](N)C(=O)O	RXN-14123