Analyte Name

all-trans-Retinal Dimer-PE Trifluoroacetic Acid Salt

Molecular Formula

C77H126NO8P • C2HF3O2

Molecular Weight

1338.82

Accurate Mass

1337.91

SMILES

CC1(C)C(/C=C/C(C)=C/C=C/C2(C)CC(/C=C/C=C(C)/C=C/C3=C(C)CCCC3(C)C)=CC=C2/C=N/CCOP(O)(OCC(OC(CCCCCCCCCCCCCCC)=O)COC(CCCCCCCCCCCCCCC)=O)=O)=C(C)CCC1.OC(C(F)(F)F)=O

InChI

InChI=1S/C77H126NO8P.C2HF3O2/c1-12-14-16-18-20-22-24-26-28-30-32-34-36-47-73(79)83-62-70(86-74(80)48-37-35-33-31-29-27-25-23-21-19-17-15-13-2)63-85-87(81,82)84-59-58-78-61-69-52-51-68(46-38-42-64(3)49-53-71-66(5)44-40-55-75(71,7)8)60-77(69,11)57-39-43-65(4)50-54-72-67(6)45-41-56-76(72,9)10;3-2(4,5)1(6)7/h38-39,42-43,46,49-54,57,61,70H,12-37,40-41,44-45,47-48,55-56,58-60,62-63H2,1-11H3,(H,81,82);(H,6,7)/b46-38+,53-49+,54-50+,57-39+,64-42+,65-43+,78-61+;

IUPAC

2,2,2-trifluoroacetic acid--3-((hydroxy(2-(((E)-(6-methyl-4,6-bis((1E,3E,5E)-4-methyl-6-(2,6,6-trimethylcyclohex-1-en-1-yl)hexa-1,3,5-trien-1-yl)cyclohexa-1,3-dien-1-yl)methylene)amino)ethoxy)phosphoryl)oxy)propane-1,2-diyl dipalmitate (1/1)

Alternate CAS Number

860448-25-5

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat