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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H16N2O4S
Molecular Weight 272.321
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of THIENAMYCIN

SMILES

C[C@@H](O)[C@@H]1[C@H]2CC(SCCN)=C(N2C1=O)C(O)=O

InChI

InChIKey=WKDDRNSBRWANNC-ATRFCDNQSA-N
InChI=1S/C11H16N2O4S/c1-5(14)8-6-4-7(18-3-2-12)9(11(16)17)13(6)10(8)15/h5-6,8,14H,2-4,12H2,1H3,(H,16,17)/t5-,6-,8-/m1/s1

HIDE SMILES / InChI

Molecular Formula C11H16N2O4S
Molecular Weight 272.321
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

Substance Class Chemical
Record UNII
WMW5I5964P
Record Status Validated (UNII)
Record Version