3-[[(2R)-2-Amino-2-carboxyethyl]thio]-5-hydroxy-L-tyrosine
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![3-[[(2R)-2-Amino-2-carboxyethyl]thio]-5-hydroxy-L-tyrosine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/94b32b9bbe794547986902c7cd6a2f03.png "3-[[(2R)-2-Amino-2-carboxyethyl]thio]-5-hydroxy-L-tyrosine")
3-[[(2R)-2-Amino-2-carboxyethyl]thio]-5-hydroxy-L-tyrosine
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CAS No:
19641-92-0
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Formula:
C12H16N2O6S
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Chemical Name:
3-[[(2R)-2-Amino-2-carboxyethyl]thio]-5-hydroxy-L-tyrosine
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Synonyms:
L-Tyrosine,3-[[(2R)-2-amino-2-carboxyethyl]thio]-5-hydroxy-;Alanine,3-[3-[(2-amino-2-carboxyethyl)thio]-4,5-dihydroxyphenyl]-,L-;L-Tyrosine,3-[(2-amino-2-carboxyethyl)thio]-5-hydroxy-,(R)-;3-[[(2R)-2-Amino-2-carboxyethyl]thio]-5-hydroxy-L-tyrosine;Cysteinyldopa;5-S-L-Cysteinyl-L-dopa;5-S-Cysteinyl-DOPA;67240-27-1
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CAS No:
Description
Found in large amounts in the plasma and urine of patients with malignant melanoma. It is therefore used in the diagnosis of melanoma and for the detection of postoperative metastases. Cysteinyldopa is believed to be formed by the rapid enzymatic hydrolysis of 5-S-glutathionedopa found in melanin-producing cells.
Computed Properties
Molecular Weight:316.33
XLogP3:-5.2
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:7
Exact Mass:316.07290741
Monoisotopic Mass:316.07290741
Topological Polar Surface Area:192
Heavy Atom Count:21
Complexity:383
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-[[(2R)-2-Amino-2-carboxyethyl]thio]-5-hydroxy-L-tyrosine
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