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Details

Stereochemistry EPIMERIC
Molecular Formula C12H22N2O4S2
Molecular Weight 322.444
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2S)-2-(((2RS)-2-(ACETYLAMINO)-4-(METHYLSULFANYL)BUTANOYL)AMINO)-4-(METHYLSULFANYL)BUTANOIC ACID

SMILES

CSCC[C@H](NC(=O)C(CCSC)NC(C)=O)C(O)=O

InChI

InChIKey=VIVKXFPMQBCQAC-AXDSSHIGSA-N
InChI=1S/C12H22N2O4S2/c1-8(15)13-9(4-6-19-2)11(16)14-10(12(17)18)5-7-20-3/h9-10H,4-7H2,1-3H3,(H,13,15)(H,14,16)(H,17,18)/t9?,10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H22N2O4S2
Molecular Weight 322.444
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
51XHX4G94E
Record Status Validated (UNII)
Record Version