Analyte Name

Piperacillin Oxalylamide

CAS Number

64844-70-8

Molecular Formula

C23H29N5O8S

Molecular Weight

535.57

Accurate Mass

535.1737

SMILES

CCN(CCNC(=O)N[C@@H](C(=O)N[C@H]1[C@H]2SC(C)(C)[C@@H](N2C1=O)C(=O)O)c3ccccc3)C(=O)C(=O)O

InChI

InChI=1S/C23H29N5O8S/c1-4-27(18(31)21(34)35)11-10-24-22(36)26-13(12-8-6-5-7-9-12)16(29)25-14-17(30)28-15(20(32)33)23(2,3)37-19(14)28/h5-9,13-15,19H,4,10-11H2,1-3H3,(H,25,29)(H,32,33)(H,34,35)(H2,24,26,36)/t13-,14-,15+,19-/m1/s1

IUPAC

(2S,5R,6R)-6-((R)-2-(3-(2-(1-carboxy-N-ethylformamido)ethyl)ureido)-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Storage Temperature

-20°C

Shipping Temperature

Blue Ice

Country of Origin

CANADA

Product Format

Neat