CID 52927460

Pg(o-20:0/0:0)

Structural Information

Molecular Formula
C26H55O8P
SMILES
CCCCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)(O)OC[C@H](CO)O)O
InChI
InChI=1S/C26H55O8P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-32-22-26(29)24-34-35(30,31)33-23-25(28)21-27/h25-29H,2-24H2,1H3,(H,30,31)/t25-,26+/m0/s1
InChIKey
HZOWMFFMQBPFBK-IZZNHLLZSA-N
Compound name
[(2S)-2,3-dihydroxypropyl] [(2R)-2-hydroxy-3-icosoxypropyl] hydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

526.36346 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 527.37074 232.3
[M+Na]+ 549.35268 231.2
[M-H]- 525.35618 221.4
[M+NH4]+ 544.39728 229.4
[M+K]+ 565.32662 229.4
[M+H-H2O]+ 509.36072 220.9
[M+HCOO]- 571.36166 235.2
[M+CH3COO]- 585.37731 240.3
[M+Na-2H]- 547.33813 213.0
[M]+ 526.36291 227.8
[M]- 526.36401 227.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe