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Alanine, 3-(2,5-dihydroxyphenyl)-

HCID 6453586
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
582-32-1
Standard SMILES
N[C@@H](Cc1cc(O)ccc1O)C(=O)O
InChIKey
GWVBDUDVLOEOHB-ZETCQYMHSA-N
Molecular formula
C9H11NO4
Average molar mass
197.19 g/mol
Monoisotopic mass
197.06880783

Names & identifiers

Preferred name
Alanine, 3-(2,5-dihydroxyphenyl)-
IUPAC
(2S)-2-amino-3-(2,5-dihydroxyphenyl)propanoic acid

Names & synonyms

Alanine, 3-(2,5-dihydroxyphenyl)-582-32-13-(2,5-Dihydroxyphenyl)alanineDTXSID80206942RefChem:317956DTXCID10129433(S)-2-Amino-3-(2,5-dihydroxyphenyl)propanoic acid32361-24-3(2S)-2-amino-3-(2,5-dihydroxyphenyl)propanoic acid2,5-Dihydroxy-L-Phenylalanine(S)-2-Amino-3-(2,5-dihydroxyphenyl)propanoicacidLevodopa Impurity 9
Show more names
2,5-DihydroxyphenylalaninSCHEMBL8540405DB-328077

Database identifiers

CAS
582-32-1
PubChem CID
6453586
DTXSID
DTXSID80206942
Nikkaji
J133.124H

Properties

Computed structural properties

XLogP
-2.1
Topological polar surface area
104 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
14
Formal charge
0
Complexity
209

Related reactions

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Compound notes

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