Chem
J-GLOBAL ID：200907047351244603   Nikkaji number：J1.105.655E

5-S-Cysteinyl-D-dopa

5-S-システイニル-D-ドーパ
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C12H16N2O6S
Molecular formula furigana： C12-H16-N2-O6-S
Molecular weight： 316.330
InChI： InChI=1S/C12H16N2O6S/c13-6(11(17)18)1-5-2-8(15)10(16)9(3-5)21-4-7(14)12(19)20/h2-3,6-7,15-16H,1,4,13-14H2,(H,17,18)(H,19,20)/t6-,7+/m1/s1
InChI key： SXISMOAILJWTID-RQJHMYQMSA-N
SMILES： N[C@@H](CSc1cc(C[C@@H](N)C(=O)O)cc(O)c1O)C(=O)O
Systematic name  (3)：
  • S-[2,3-ジヒドロキシ-5-[(R)-2-アミノ-2-カルボキシエチル]フェニル]-L-システイン
  • (2R)-2-アミノ-3-({5-[(2R)-2-アミノ-2-カルボキシエチル]-2,3-ジヒドロキシフェニル}スルファニル)プロパン酸
  • (2R)-2-amino-3-({5-[(2R)-2-amino-2-carboxyethyl]-2,3-dihydroxyphenyl}sulfanyl)propanoic acid
Other name (3)：
  • S-[2,3-Dihydroxy-5-[(R)-2-amino-2-carboxyethyl]phenyl]-L-cysteine
  • 5-S-システイニル-D-ドーパ
  • 5-S-Cysteinyl-D-dopa
CAS registry number： 19641-92-0
KEGG COMPOUND： C17935
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