Analyte Name

Oxytocin-d5 Trifluoroacetate

Molecular Formula

C45H62D5F3N12O14S2

Molecular Weight

1126.24

SMILES

O=C([C@H]1N(C([C@@H](NC([C@H](CC(N)=O)NC([C@H](CCC(N)=O)NC(C([C@@H](C)CC)NC([C@H](CC2=CC=C(O)C=C2)N3)=O)=O)=O)=O)CSSC[C@H](N)C3=O)=O)CCC1)N[C@@H](CC(C)C)C(NCC(N)=O)=O.O=C(O)C(F)(F)F

InChI

InChI=1S/C43H66N12O12S2/c1-5-22(4)35-41(65)48-25(12-13-32(44)57)37(61)49-27(17-33(45)58)38(62)51-30(20-69-43(67)29(19-68)54-53-28(39(63)52-35)16-23-8-10-24(56)11-9-23)42(66)55-14-6-7-31(55)40(64)50-26(15-21(2)3)36(60)47-18-34(46)59/h8-11,21-22,25-31,35,53-54,56,68H,5-7,12-20H2,1-4H3,(H2,44,57)(H2,45,58)(H2,46,59)(H,47,60)(H,48,65)(H,49,61)(H,50,64)(H,51,62)(H,52,63)/t22-,25-,26-,27-,28-,29-,30-,31-,35-/m0/s1/i2D3,18D2/t21?,22-,25-,26-,27-,28-,29-,30-,31-,35-

Unlabelled CAS Number

Free amine: 50-56-6

SIL Type

Deuterium

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

API Family

Oxytocin