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N-[(5-Chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-yl)(hydroxy)methylidene]tyrosine

HCID 3036282
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Basic informationNames & identifiersRelated reactionsCompound notes
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Basic information

CAS
53011-67-9
Standard SMILES
CC1Cc2c(Cl)cc(C(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)O)c(O)c2C(=O)O1
InChIKey
NMPHXGOYUUBGIK-POGJTHQKSA-N
Molecular formula
C20H18ClNO7
Average molar mass
419.817 g/mol
Monoisotopic mass
419.0771796

Names & identifiers

Preferred name
N-[(5-Chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-yl)(hydroxy)methylidene]tyrosine
IUPAC
N-[(5-Chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-yl)(hydroxy)methylidene]-L-tyrosine

Database identifiers

CAS
53011-67-9
PubChem CID
3036282
DTXSID
DTXSID60967504
Nikkaji
J96.566I

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Compound notes

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