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H-Tyr-Val-OH

CAT: 0121-4008208.0001Size: 1 gDry Ice: NoHazardous: No
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CAT#:0121-4008208.0001Size:1 g
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CAS Number
17355-09-8
Specifications
G-3490.0001
Sequence
H-Tyr-Val-OH
Molecular Formula
C₁₄H₂₀N₂O₄
Molecular Weight
280.32
Shipping Conditions
Ambient Temperature
Storage Temperature
< -15°C

Chemical Information

Tyrosylvaline
CAS Number17355-09-8
PubChem CID14767562
IUPAC Name2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoic acid
Molecular FormulaC14H20N2O4
Molecular Weight280.32
XLogP-2
Topological Polar Surface Area113
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count20
Formal Charge0
Complexity338
SMILES
CC(C)C(C(=O)O)NC(=O)C(CC1=CC=C(C=C1)O)N
InChI
InChI=1S/C14H20N2O4/c1-8(2)12(14(19)20)16-13(18)11(15)7-9-3-5-10(17)6-4-9/h3-6,8,11-12,17H,7,15H2,1-2H3,(H,16,18)(H,19,20)
InChIKey
OYOQKMOWUDVWCR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tyrosylvaline
CAS: 17355-09-8
CID: 14767562
Formula: C14H20N2O4
MW: 280.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight280.32
XLogP3-2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass280.14230712
Monoisotopic Mass280.14230712
Topological Polar Surface Area113 Ų
Heavy Atom Count20
Formal Charge0
Complexity338
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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