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H-Asp-Lys-OH

CAT: 0926-FA108003Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0926-FA108003Size:250 mg
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CAS Number
5891-51-0
MDL Number
MFCD00038206
Smiles
C (CCN) C[C@@H] (C (=O) O) NC (=O) [C@H] (CC (=O) O) N
Molecular Formula
C10H19N3O5
Molecular Weight
261.28 g/mol
Controlled
No

Chemical Information

Asp-Lys

Asp-Lys is a dipeptide formed from L-alpha-aspartyl and L-lysine residues. It has a role as a metabolite. It is functionally related to a L-aspartic acid and a L-lysine. It is a tautomer of an Asp-Lys zwitterion.

CAS Number5891-51-0
PubChem CID6427003
IUPAC Name(2S)-6-amino-2-[[(2S)-2-amino-3-carboxypropanoyl]amino]hexanoic acid
Molecular FormulaC10H19N3O5
Molecular Weight261.28
XLogP-6.6
Topological Polar Surface Area156
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Heavy Atom Count18
Formal Charge0
Complexity308
SMILES
C(CCN)C[C@@H](C(=O)O)NC(=O)[C@H](CC(=O)O)N
InChI
InChI=1S/C10H19N3O5/c11-4-2-1-3-7(10(17)18)13-9(16)6(12)5-8(14)15/h6-7H,1-5,11-12H2,(H,13,16)(H,14,15)(H,17,18)/t6-,7-/m0/s1
InChIKey
OAMLVOVXNKILLQ-BQBZGAKWSA-N
Chemical Structure
2D Structure
2D structure of Asp-Lys
CAS: 5891-51-0
CID: 6427003
Formula: C10H19N3O5
MW: 261.28
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight261.28
XLogP3-6.6
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Exact Mass261.13247072
Monoisotopic Mass261.13247072
Topological Polar Surface Area156 Ų
Heavy Atom Count18
Formal Charge0
Complexity308
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes