chempirical

Val-tyr

C14H20N2O4CAS 3061-91-4280.32 g/mol

Open in Covalent MOL file
H2NONHOHOHO
AmideCarboxylic acidPhenolPrimary amine

Properties

Molecular formula
C14H20N2O4
Molar mass
280.32 g/mol
Exact mass
280.1423 Da
logP
1.33Crippen estimate
Polar surface area
116.1 Ų
H-bond donors / acceptors
4 / 4
Rotatable bonds
6
Stereocentres
S, Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
3061-91-4
SMILES
CC(C)[C@H](N)C(O)=N[C@@H](Cc1ccc(O)cc1)C(=O)O
InChIKey
VEYJKJORLPYVLO-RYUDHWBXSA-N
InChI
InChI=1S/C14H20N2O4/c1-8(2)12(15)13(18)16-11(14(19)20)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)/t11-,12-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

15 names · show all
  • L-Valyl-L-tyrosine
  • L-Tyrosine, L-valyl-
  • Tyrosine, N-L-valyl-, L-
  • L-Tyrosine, N-L-valyl-
  • Tyrosine, N-valyl-
  • N-L-Valyl-L-tyrosine
  • Valyltyrosine
  • 22: PN: WO03052099 PAGE: 84 claimed protein
  • 29: PN: WO2005081628 SEQID: 1029 claimed protein
  • 99: PN: US20070066537 PAGE: 17 claimed protein
  • 23: PN: US20090239809 SEQID: 23 claimed protein
  • 457: PN: EP2161028 TABLE: 4 claimed protein
  • 138: PN: WO2012013136 SEQID: 183 claimed protein
  • 6: PN: WO2012056205 TABLE: 1 claimed sequence
  • 5: PN: JP2014003971 PAGE: 22 claimed sequence

Work with Val-tyr

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

L-Alanyl-L-tyrosine3061-88-974 % similar D-Leucyl-L-tyrosine3303-29-568 % similar Leucyltyrosine968-21-868 % similar Glycyl-L-tyrosine658-79-760 % similar N-Acetyl-DL-tyrosine2901-77-160 % similar N-Acetyl-L-tyrosine537-55-360 % similar Alanylphenylalanine1999-45-758 % similar L-Alanyl-L-phenylalanine3061-90-358 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

ε-(Benzyloxycarbonyl)-L-lysine1155-64-2 4-Amino-N-[(1,1-dimethylethoxy)carbonyl]-D-phenylalanine164332-89-2 Boc-(S)-3-amino-4-(4-pyridyl)-butyric acid219297-13-9 N-α-Benzyloxycarbonyl-L-lysine2212-75-1 H-D-Lys(Z)-oh34404-32-5 Boc-4-amino-L-phenylalanine55533-24-9 Z-D-Lys-oh70671-54-4

Elsewhere

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