CID 131757968

Tracylglycerol(24:0/20:0/18:0)

Structural Information

Molecular Formula
C65H128O5
SMILES
CCCCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCC
InChI
InChI=1S/C65H128O5/c1-4-7-10-13-16-19-22-25-28-31-32-33-34-36-37-40-43-46-49-52-55-58-64(66)69-62-63(61-68-60-57-54-51-48-45-42-39-30-27-24-21-18-15-12-9-6-3)70-65(67)59-56-53-50-47-44-41-38-35-29-26-23-20-17-14-11-8-5-2/h63H,4-62H2,1-3H3/t63-/m1/s1
InChIKey
XZZFQBJMKOQUSE-AFLCPGBUSA-N
Compound name
[(2R)-2-icosanoyloxy-3-octadecoxypropyl] tetracosanoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

988.9762 Da
Monoisotopic Mass

29.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 989.98348 350.7
[M+Na]+ 1011.9654 348.3
[M+NH4]+ 1007.0100 351.3
[M+K]+ 1027.9394 354.0
[M-H]- 987.96892 326.4
[M+Na-2H]- 1009.9509 340.5
[M]+ 988.97565 344.9
[M]- 988.97675 344.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.