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2-[(2-Amino-4-methylpentanoyl)amino]-3-hydroxypropanoic acid

HCID 3621685
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Basic information

CAS
6209-12-7
Standard SMILES
CC(C)CC(N)C(=O)NC(CO)C(=O)O
InChIKey
XGDCYUQSFDQISZ-UHFFFAOYSA-N
Molecular formula
C9H18N2O4
Average molar mass
218.25 g/mol
Monoisotopic mass
218.12665706

Names & identifiers

Preferred name
2-[(2-Amino-4-methylpentanoyl)amino]-3-hydroxypropanoic acid
IUPAC
2-[(2-amino-4-methylpentanoyl)amino]-3-hydroxypropanoic acid
English name
H-Leu-Ser-OH
Molecular formula
C9H18N2O4
Molecular weight
218.25

Names & synonyms

ST51015033LS dipeptideL-S DipeptideLeucine Serine dipeptideLeucine-Serine dipeptide2-[(2-amino-4-methylpentanoyl)amino]-3-hydroxypropanoic acidSCHEMBL8945299DTXSID10394386LSAKOS010402905FL108102EN300-297391
Show more names
leu-serLeucyl-serine2,6-Dichloro-3-nitroanisoleLeu-Ser-OHH-Leu-Ser-OHN-LeucylserineL-Leu-L-Ser-OHL-LEUCYL-L-SERINEL-Serine, L-leucyl-N-L-leucyl-L-serine
L0128802-(2-amino-4-methylpentanamido)-3-hydroxypropanoic acid2-(2-amino-4-methylpentanoylamino)-3-hydroxypropanoic acid

Database identifiers

CAS
6209-12-7
PubChem CID
3621685
DTXSID
DTXSID10394386

Properties

Computed structural properties

XLogP
-3.4
Topological polar surface area
113 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
15
Formal charge
0
Complexity
230

Experimental & physicochemical properties

LogP-3.17
Physical DescriptionSolid

Physicochemical properties

storage temp.
20 °C · −20°C
form
powder
color
white
Sequence
H-Leu-Ser-OH
WGK Germany
3 · 3

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

wgk
3

Chemistry & industry

Applications

UsesH-Leu-Ser-OH is a dipeptide formed from L-leucine and L-serine residues and is a metabolite[1].

Additional notes

DefinitionChEBI: Leu-Ser is a dipeptide formed from L-leucine and L-serine residues. It has a role as a metabolite. It is functionally related to a L-leucine and a L-serine.

Related reactions

1 records
New reaction record
HRID 2331869 reaction equation
HRID 2331869As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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