Analyte Name

Di-O-cysteinyl-glycinoyl Curcumin-d6

Molecular Formula

C31 D6 H30 N4 O10 S2

Molecular Weight

694.805

Accurate Mass

694.225

SMILES

[2H]C([2H])([2H])Oc1cc(\C=C\C(=O)CC(=O)\C=C\c2ccc(OC(=O)CNC(=O)[C@@H](N)CS)c(OC([2H])([2H])[2H])c2)ccc1OC(=O)CNC(=O)[C@H](N)CS

InChI

InChI=1S/C31H36N4O10S2/c1-42-26-11-18(5-9-24(26)44-28(38)14-34-30(40)22(32)16-46)3-7-20(36)13-21(37)8-4-19-6-10-25(27(12-19)43-2)45-29(39)15-35-31(41)23(33)17-47/h3-12,22-23,46-47H,13-17,32-33H2,1-2H3,(H,34,40)(H,35,41)/b7-3+,8-4+/t22-,23+/i1D3,2D3

IUPAC

[4-[(1E,6E)-7-[4-[2-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]acetyl]oxy-3-(trideuteriomethoxy)phenyl]-3,5-dioxohepta-1,6-dienyl]-2-(trideuteriomethoxy)phenyl] 2-[[(2S)-2-amino-3-sulfanylpropanoyl]amino]acetate

Unlabelled CAS Number

1042019-87-3

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat