Analyte Name

2-((4-Nitrophenyl)methyl) (4R,5S,6S)-3-(((3S,5S)-5-(((3-Carboxyphenyl)amino)carbonyl)-3-pyrrolidinyl)thio)-6-((1R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo(3.2.0)hept-2-ene-2-carboxylic Acid Ester

CAS Number

503607-50-9

Molecular Formula

C29H30N4O9S

Molecular Weight

610.63

Accurate Mass

610.17

SMILES

O=C1[C@@]([C@H](O)C)([H])[C@]2([H])N1C(C(OCC3=CC=C([N+]([O-])=O)C=C3)=O)=C(S[C@@H]4CN[C@H](C(NC5=CC(C(O)=O)=CC=C5)=O)C4)[C@@H]2C

InChI

InChI=1S/C29H30N4O9S/c1-14-23-22(15(2)34)27(36)32(23)24(29(39)42-13-16-6-8-19(9-7-16)33(40)41)25(14)43-20-11-21(30-12-20)26(35)31-18-5-3-4-17(10-18)28(37)38/h3-10,14-15,20-23,30,34H,11-13H2,1-2H3,(H,31,35)(H,37,38)/t14-,15-,20+,21+,22-,23-/m1/s1

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat