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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H12N2O4S
Molecular Weight 208.235
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LANTHIONINE

SMILES

N[C@@H](CSC[C@H](N)C(O)=O)C(O)=O

InChI

InChIKey=DWPCPZJAHOETAG-IMJSIDKUSA-N
InChI=1S/C6H12N2O4S/c7-3(5(9)10)1-13-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)/t3-,4-/m0/s1

HIDE SMILES / InChI

Molecular Formula C6H12N2O4S
Molecular Weight 208.235
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

Substance Class Chemical
Record UNII
JO78O46X3K
Record Status Validated (UNII)
Record Version