Ketcher 11211914142D 1   1.00000     0.00000     0

  7  6  0     1  0            999 V2000
   -0.8661    0.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7320   -0.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7320   -0.2000    0.0000 Se  0  0  0  0  0  0  0  0  0  0  0  0
    0.8661    0.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8661    1.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  6  4  1  0     0  0
  2  4  1  0     0  0
  1  6  1  0     0  0
  3  1  1  0     0  0
  4  5  2  0     0  0
  6  7  1  1     0  0
M  END
> <ID>
CHEBI:16633

> <NAME>
L-selenocysteine

> <DEFINITION>
The L-enantiomer of selenocysteine.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:21385; CHEBI:49562; CHEBI:6298; CHEBI:13165

> <SYNONYM>
Selenocysteine; SELENOCYSTEINE; L-Selenozystein; L-Selenocysteine; L-Selenocystein; 3-selenyl-L-alanine

> <IUPAC_NAME>
(2R)-2-amino-3-selanylpropanoic acid

> <FORMULA>
C3H7NO2Se

> <MASS>
168.065

> <MONOISOTOPIC_MASS>
168.96420

> <CHARGE>
0

> <SMILES>
C([C@@H](C(O)=O)N)[SeH]

> <INCHI>
InChI=1S/C3H7NO2Se/c4-2(1-7)3(5)6/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1

> <INCHIKEY>
ZKZBPNGNEQAJSX-REOHCLBHSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
2498378

> <CAS_REGISTRY_NUMBER>
10236-58-5

> <REAXYS_REGISTRY_NUMBER>
2498378

> <CHEMIDPLUS>
10236-58-5

> <ECMDB_ACCESSION>
ECMDB03288

> <KEGG_COMPOUND_ACCESSION>
C05688

> <METACYC_ACCESSION>
L-SELENOCYSTEINE

> <PDBECHEM_ACCESSION>
SEC

> <WIKIPEDIA_ACCESSION>
Selenocysteine

> <PUBMED_CITATION>
11733012; 18429173

$$$$