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Pro-Hyp-OH

CAT: 0926-FP49344-04Size: 0.5 gDry Ice: NoHazardous: No
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CAT#:0926-FP49344-04Size:0.5 g
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CAS Number
18684-24-7
MDL Number
MFCD00037349
Smiles
C1CC (NC1) C (=O) N2CC (CC2C (=O) O) O
Molecular Formula
C10H16N2O4
Molecular Weight
228.25 g/mol
Controlled
No

Chemical Information

Prolylhydroxyproline

Pro-Hyp is a dipeptide composed of L-proline and L-hydroxyproline residues. It is a biomarker for bone collagen degradation. It has a role as a diagnostic agent, a biomarker and a human metabolite. It is functionally related to a L-proline and a trans-4-hydroxy-L-proline. It is a tautomer of a Pro-Hyp zwitterion.

CAS Number18684-24-7
PubChem CID11902893
IUPAC Name(2S,4R)-4-hydroxy-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
Molecular FormulaC10H16N2O4
Molecular Weight228.24
XLogP-3.3
Topological Polar Surface Area89.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity307
SMILES
C1C[C@H](NC1)C(=O)N2C[C@@H](C[C@H]2C(=O)O)O
InChI
InChI=1S/C10H16N2O4/c13-6-4-8(10(15)16)12(5-6)9(14)7-2-1-3-11-7/h6-8,11,13H,1-5H2,(H,15,16)/t6-,7+,8+/m1/s1
InChIKey
ONPXCLZMBSJLSP-CSMHCCOUSA-N
Chemical Structure
2D Structure
2D structure of Prolylhydroxyproline
CAS: 18684-24-7
CID: 11902893
Formula: C10H16N2O4
MW: 228.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight228.24
XLogP3-3.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass228.11100700
Monoisotopic Mass228.11100700
Topological Polar Surface Area89.9 Ų
Heavy Atom Count16
Formal Charge0
Complexity307
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes