Benzylpenicillenic acid

Molecular Formula: C₁₆H₁₈N₂O₄S

InChI: InChI=1/C16H18N2O4S/c1-16(2,23)13(14(19)20)17-9-11-15(21)22-12(18-11)8-10-6-4-3-5-7-10/h3-7,9,13,17,23H,8H2,1-2H3,(H,19,20)/b11-9+/f/h19H

InChIKey: InChIKey=WGIWOHWWPXKJMS-QKHZAEAFDB
SMILES: CC(C)(C(C(=O)O)NC=C1C(=O)OC(=N1)CC2=CC=CC=C2)S

Names:
    Benzylpenicillenic acid
    Valine, 3-mercapto-N-((5-oxo-2-(phenylmethyl)-4(5H)-oxazolylidene)methyl)-
    2-[[(E)-(2-benzyl-5-oxo-1,3-oxazol-4-ylidene)methyl]amino]-3-methyl-3-sulfanyl-butanoic acid
    3264-88-8

Registries:
    PubChem CID 5464040
    PubChem ID 207078