Structure Database (LMSD)

Common Name
dolichyl beta-D-glucosyl phosphate
Systematic Name
α-(3-methylbut-2-en-1-yl)-ω-{4-[(β-D-glucopyranosyloxy)(hydroxy)phosphoryloxy]-2-methylbutyl}poly[(2E)-2-methylbut-2-ene-1,4-diyl]
Synonyms
  • Dolichyl beta-D-glucosyl phosphate
  • dolichyl beta-D-glucosyl phosphate
LM ID
LMPR03080014
Status
Active
Exact Mass
Calculate m/z
602.358373
Formula
C31H55O9P
Show lipids differing only in stereochemistry/bond geometry
Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

Category
Main Class
Sub Class
Prenol Lipids [PR]
Polyprenols [PR03]
Dolichol monophosphates [PR0308]

String Representations

InChiKey (Click to copy)
AGLXCEGQRIYVRV-DVDHLLHCSA-N
InChi (Click to copy)
InChI=1S/C31H55O9P/c1-22(2)11-7-12-23(3)13-8-14-24(4)15-9-16-25(5)17-10-18-26(6)19-20-38-41(36,37)40-31-30(35)29(34)28(33)27(21-32)39-31/h11,13,15,17,26-35H,7-10,12,14,16,18-21H2,1-6H3,(H,36,37)/b23-13+,24-15+,25-17-/t26?,27-,28-,29+,30-,31+/m1/s1
SMILES (Click to copy)
C(/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C)C/C(=C\CCC(CCOP(O)(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C)/C

References

Other Databases

KEGG ID
C01246
CHEBI ID
15812
PubChem CID
56940678

Calculated Physicochemical Properties

Heavy Atoms 41
Rings 1
Aromatic Rings 0
Rotatable Bonds 19
Van der Waals Molecular Volume 620.88
Topological Polar Surface Area 147.98
Hydrogen Bond Donors 5
Hydrogen Bond Acceptors 9
logP 8.04
Molar Refractivity 165.45

Admin

Created at
-
Updated at
13th Sep 2021