PubChemLite - Dolichyl diphosphate (C25H46O7P2)

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)OP(=O)(O)O

InChI

InChI=1S/C25H46O7P2/c1-21(2)11-7-12-22(3)13-8-14-23(4)15-9-16-24(5)17-10-18-25(6)19-20-31-34(29,30)32-33(26,27)28/h11,13,15,17,25H,7-10,12,14,16,18-20H2,1-6H3,(H,29,30)(H2,26,27,28)/b22-13+,23-15+,24-17-

InChIKey

MXGLYEVGJRXBTP-QOLULZROSA-N

Compound name

[(6Z,10E,14E)-3,7,11,15,19-pentamethylicosa-6,10,14,18-tetraenyl] phosphono hydrogen 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]+	521.27913	217.1
[M+Na]+	543.26107	221.1
[M-H]-	519.26457	216.6
[M+NH4]+	538.30567	224.2
[M+K]+	559.23501	219.0
[M+H-H2O]+	503.26911	200.5
[M+HCOO]-	565.27005	220.4
[M+CH3COO]-	579.28570	240.5
[M+Na-2H]-	541.24652	202.0
[M]+	520.27130	213.5
[M]-	520.27240	213.5

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

521.27913

217.1

[M+Na]+

543.26107

221.1

[M-H]-

519.26457

216.6

[M+NH4]+

538.30567

224.2

[M+K]+

559.23501

219.0

[M+H-H2O]+

503.26911

200.5

[M+HCOO]-

565.27005

220.4

[M+CH3COO]-

579.28570

240.5

[M+Na-2H]-

541.24652

202.0

[M]+

520.27130

213.5

[M]-

520.27240

213.5

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

Dolichyl diphosphate

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe