KBioSS_001413

Molecular Formula: C₁₆H₁₈N₂O₄S

InChI: InChI=1/C16H18N2O4S/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t11-,12+,14-/m1/s1/f/h17,21H

InChIKey: InChIKey=JGSARLDLIJGVTE-JGBPDRTNDF
SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CC=C3)C(=O)O)C

Names:
    KBioSS_001413
    (2R,5R,6S)-3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Registries:
    PubChem CID 5904
    PubChem ID 11377113