H-Ala-Met-OH

CAT: 0926-FA107970-01Size: 2000 mgDry Ice: NoHazardous: No

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CAT#:0926-FA107970-01Size:2000 mg

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CAS Number

14486-05-6

MDL Number

MFCD00066034

Smiles

C[C@@H] (C (=O) N[C@@H] (CCSC) C (=O) O) N

Molecular Formula

C8H16N2O3S

Molecular Weight

220.29 g/mol

Controlled

Chemical Information

Alanyl-methionine

Ala-Met is a dipeptide formed from L-alanyl and L-methionine residues. It has a role as a metabolite.

CAS Number	14486-05-6
PubChem CID	85744
IUPAC Name	(2S)-2-[[(2S)-2-aminopropanoyl]amino]-4-methylsulfanylbutanoic acid
Molecular Formula	C8H16N2O3S
Molecular Weight	220.29
XLogP	-3.2
Topological Polar Surface Area	118
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	14
Formal Charge	0
Complexity	211

SMILES

C[C@@H](C(=O)N[C@@H](CCSC)C(=O)O)N

InChI

InChI=1S/C8H16N2O3S/c1-5(9)7(11)10-6(8(12)13)3-4-14-2/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t5-,6-/m0/s1

InChIKey

FSHURBQASBLAPO-WDSKDSINSA-N

Chemical Structure

2D Structure

CAS: 14486-05-6

CID: 85744

Formula: C8H16N2O3S

MW: 220.29

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	220.29
XLogP3	-3.2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	220.08816355
Monoisotopic Mass	220.08816355
Topological Polar Surface Area	118 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	211
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes