L,L-Dityrosine-13C12 Dihydrochloride

Analyte Name

L,L-Dityrosine-13C12 Dihydrochloride

Molecular Formula

C6¹³C12H22Cl2N2O6

Molecular Weight

445.19

Accurate Mass

444.13

SMILES

N[C@H](C(O)=O)C[13C]1=[13CH][13C]([13C]2=[13C](O)[13CH]=[13CH][13C](C[C@@H](C(O)=O)N)=[13CH]2)=[13C](O)[13CH]=[13CH]1.Cl.Cl

InChI

InChI=1S/C18H20N2O6.2ClH/c19-13(17(23)24)7-9-1-3-15(21)11(5-9)12-6-10(2-4-16(12)22)8-14(20)18(25)26;;/h1-6,13-14,21-22H,7-8,19-20H2,(H,23,24)(H,25,26);2*1H/i1+1,2+1,3+1,4+1,5+1,6+1,9+1,10+1,11+1,12+1,15+1,16+1;;

IUPAC

(2S,2'S)-3,3'-(6,6'-dihydroxy-[1,1'-biphenyl]-3,3'-diyl-1,1',2,2',3,3',4,4',5,5',6,6'-13C12)bis(2-aminopropanoic acid) dihydrochloride

Unlabelled CAS Number

221308-01-6

SIL Type

Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat