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6-Biopterin 50mg

CAT: 0628-A13901-50Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0628-A13901-50Size:50 mg
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CAS Number
22150-76-1

Chemical Information

Biopterin

L-erythro-biopterin is a biopterin in which the 1,2-dihydroxypropyl group has (1R,2S)-configuration; naturally occurring form. It is an enantiomer of a D-erythro-biopterin.

CAS Number22150-76-1
PubChem CID135403659
IUPAC Name2-amino-6-[(1R,2S)-1,2-dihydroxypropyl]-3H-pteridin-4-one
Molecular FormulaC9H11N5O3
Molecular Weight237.22
XLogP-2.4
Topological Polar Surface Area134
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity348
SMILES
C[C@@H]([C@@H](C1=CN=C2C(=N1)C(=O)NC(=N2)N)O)O
InChI
InChI=1S/C9H11N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h2-3,6,15-16H,1H3,(H3,10,11,13,14,17)/t3-,6-/m0/s1
InChIKey
LHQIJBMDNUYRAM-DZSWIPIPSA-N
Chemical Structure
2D Structure
2D structure of Biopterin
CAS: 22150-76-1
CID: 135403659
Formula: C9H11N5O3
MW: 237.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight237.22
XLogP3-2.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass237.08618923
Monoisotopic Mass237.08618923
Topological Polar Surface Area134 Ų
Heavy Atom Count17
Formal Charge0
Complexity348
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

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