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Anserine 200mg

CAT: 0628-A13306-200Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0628-A13306-200Size:200 mg
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CAS Number
584-85-0

Chemical Information

Anserine

Anserine is a dipeptide comprising of beta-alanine and 3-methyl-L-histidine units. It has a role as an animal metabolite and a mouse metabolite. It is a beta-alanine derivative and a dipeptide. It is a tautomer of an anserine zwitterion.

CAS Number584-85-0
PubChem CID112072
IUPAC Name(2S)-2-(3-aminopropanoylamino)-3-(3-methylimidazol-4-yl)propanoic acid
Molecular FormulaC10H16N4O3
Molecular Weight240.26
XLogP-4
Topological Polar Surface Area110
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count17
Formal Charge0
Complexity285
SMILES
CN1C=NC=C1C[C@@H](C(=O)O)NC(=O)CCN
InChI
InChI=1S/C10H16N4O3/c1-14-6-12-5-7(14)4-8(10(16)17)13-9(15)2-3-11/h5-6,8H,2-4,11H2,1H3,(H,13,15)(H,16,17)/t8-/m0/s1
InChIKey
MYYIAHXIVFADCU-QMMMGPOBSA-N
Chemical Structure
2D Structure
2D structure of Anserine
CAS: 584-85-0
CID: 112072
Formula: C10H16N4O3
MW: 240.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight240.26
XLogP3-4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass240.12224039
Monoisotopic Mass240.12224039
Topological Polar Surface Area110 Ų
Heavy Atom Count17
Formal Charge0
Complexity285
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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