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Chemical structure of L,L-Dityrosine hydrochloride

GC36415

L,L-Dityrosine hydrochloride

Also known as (2S)-2-amino-3-[3-[5-[(2S)-2-amino-2-carboxyethyl]-2-hydroxyphenyl]-4-hydroxyphenyl]propanoic acid;dihydrochloride

L,L-Dityrosine hydrochloride (o,o'-Dityrosine hydrochloride) is a constituent of acid hydrolysates of a number of biological materials, including the insect cuticular resilin

ChemicalCAS221308-01-6MW433.28FormulaC18H22Cl2N2O6
CAS number
221308-01-6
Molecular weight
433.28
Formula
C18H22Cl2N2O6
Solubility
H2O : 125 mg/mL (288·50 mM; Need ultrasonic); DMSO : 62·5 mg/mL (144·25 mM; ultrasonic and warming and heat to 60°C)
InChIKey
MUEPHPAGIIPFFM-AXEKQOJOSA-N
Catalogue number
GC36415
Brand
GLPBIO
Computed properties PubChem CID 131851395 · TPSA 167 Ų · H-bond donors 8 · H-bond acceptors 8
TPSA
167 Ų
H-bond donors
8
H-bond acceptors
8
Rotatable bonds
7
Heavy atoms
28

SMILES C1=CC(=C(C=C1C[C@@H](C(=O)O)N)C2=C(C=CC(=C2)C[C@@H](C(=O)O)N)O)O.Cl.Cl

Computed descriptors from PubChem (CID 131851395), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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