Analyte Name

2,2'-(1,6-bis((2-Formimidamidoethyl)thio)-5,10-dioxo-2,3,5,7,8,10-hexahydrodipyrrolo[1,2-a:1',2'-d]pyrazine-3,8-diyl)bis(3-hydroxybutanoic Acid)

CAS Number

130792-44-8

Molecular Formula

C24 H34 N6 O8 S2

Molecular Weight

598.692

Accurate Mass

598.188

SMILES

CC(O)C(C1CC(=C2N1C(=O)C3=C(CC(C(C(C)O)C(=O)O)N3C2=O)SCCNC=N)SCCNC=N)C(=O)O

InChI

InChI=1S/C24H34N6O8S2/c1-11(31)17(23(35)36)13-7-15(39-5-3-27-9-25)19-22(34)30-14(18(12(2)32)24(37)38)8-16(40-6-4-28-10-26)20(30)21(33)29(13)19/h9-14,17-18,31-32H,3-8H2,1-2H3,(H2,25,27)(H2,26,28)(H,35,36)(H,37,38)

IUPAC

2-[12-(1-carboxy-2-hydroxypropyl)-4,10-bis(2-methanimidamidoethylsulfanyl)-2,8-dioxo-1,7-diazatricyclo[7.3.0.03,7]dodeca-3,9-dien-6-yl]-3-hydroxybutanoic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat