PubChemLite - Dolichol monophosphate (C25H45O4P)

Structural Information

Molecular Formula

SMILES

CC(CC/C=C(/C)\CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)CCOP(=O)(O)O

InChI

InChI=1S/C25H45O4P/c1-21(2)11-7-12-22(3)13-8-14-23(4)15-9-16-24(5)17-10-18-25(6)19-20-29-30(26,27)28/h11,13,15,17,25H,7-10,12,14,16,18-20H2,1-6H3,(H2,26,27,28)/b22-13+,23-15+,24-17-

InChIKey

GYBNOAFGEKAZTA-QOLULZROSA-N

Compound name

[(6Z,10E,14E)-3,7,11,15,19-pentamethylicosa-6,10,14,18-tetraenyl] dihydrogen phosphate

Related CIDs

2D Structure

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	441.31282	206.4
[M+Na]+	463.29476	213.8
[M-H]-	439.29826	202.3
[M+NH4]+	458.33936	211.7
[M+K]+	479.26870	211.6
[M+H-H2O]+	423.30280	199.3
[M+HCOO]-	485.30374	209.9
[M+CH3COO]-	499.31939	230.7
[M+Na-2H]-	461.28021	195.4
[M]+	440.30499	203.7
[M]-	440.30609	203.7

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

441.31282

206.4

[M+Na]+

463.29476

213.8

[M-H]-

439.29826

202.3

[M+NH4]+

458.33936

211.7

[M+K]+

479.26870

211.6

[M+H-H2O]+

423.30280

199.3

[M+HCOO]-

485.30374

209.9

[M+CH3COO]-

499.31939

230.7

[M+Na-2H]-

461.28021

195.4

[M]+

440.30499

203.7

[M]-

440.30609

203.7

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

Dolichol monophosphate

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe