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H-Val-Pro-Pro-OH

CAT: 0607-BA5190-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-BA5190-10Size:10 mg
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CAS Number
58872-39-2
Form
A solid
Molecular Formula
C15H25N3O4
Molecular Weight
311.38
Shipping Conditions
Blue ice
Storage Conditions
Tightly sealed and desiccated at -20°C, protect from light.

Chemical Information

Val-Pro-Pro

Val-Pro-Pro is a tripeptide composed of L-valine and two L-proline units joined by peptide linkages. It has a role as a metabolite. It is functionally related to a L-valine and a L-proline.

CAS Number58872-39-2
PubChem CID9818200
IUPAC Name(2S)-1-[(2S)-1-[(2S)-2-amino-3-methylbutanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
Molecular FormulaC15H25N3O4
Molecular Weight311.38
XLogP-2.1
Topological Polar Surface Area104
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count22
Formal Charge0
Complexity466
SMILES
CC(C)[C@@H](C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)O)N
InChI
InChI=1S/C15H25N3O4/c1-9(2)12(16)14(20)17-7-3-5-10(17)13(19)18-8-4-6-11(18)15(21)22/h9-12H,3-8,16H2,1-2H3,(H,21,22)/t10-,11-,12-/m0/s1
InChIKey
DOFAQXCYFQKSHT-SRVKXCTJSA-N
Chemical Structure
2D Structure
2D structure of Val-Pro-Pro
CAS: 58872-39-2
CID: 9818200
Formula: C15H25N3O4
MW: 311.38
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight311.38
XLogP3-2.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass311.18450629
Monoisotopic Mass311.18450629
Topological Polar Surface Area104 Ų
Heavy Atom Count22
Formal Charge0
Complexity466
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