Analyte Name

DAMGO Acetic Acid Salt -D4

Molecular Formula

C26H31D4N5O6 • C2H4O2

Molecular Weight

577.67

Accurate Mass

577.3

SMILES

CN(C(CNC([C@H](NC([C@H](CC1=CC=C(C=C1)O)N)=O)C)=O)=O)[C@@H](CC2=CC=CC=C2)C(NC([2H])(C([2H])([2H])O)[2H])=O.CC(O)=O

InChI

InChI=1S/C26H35N5O6.C2H4O2/c1-17(30-25(36)21(27)14-19-8-10-20(33)11-9-19)24(35)29-16-23(34)31(2)22(26(37)28-12-13-32)15-18-6-4-3-5-7-18;1-2(3)4/h3-11,17,21-22,32-33H,12-16,27H2,1-2H3,(H,28,37)(H,29,35)(H,30,36);1H3,(H,3,4)/t17-,21+,22+;/m1./s1/i12D2,13D2;

IUPAC

(S)-2-amino-N-((R)-1-((2-(((S)-1-((2-hydroxyethyl-1,1,2,2-d4)amino)-1-oxo-3-phenylpropan-2-yl)(methyl)amino)-2-oxoethyl)amino)-1-oxopropan-2-yl)-3-(4-hydroxyphenyl)propanamide acetate

Alternate CAS Number

78123-71-4

Unlabelled CAS Number

100929-53-1

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat