Basic information
- CAS
25126-51-6- Standard SMILES
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)O- InChIKey
UFPHFKCTOZIAFY-UHFFFAOYSA-N- Molecular formula
- C55H91O4P
- Average molar mass
- 847.3 g/mol
- Monoisotopic mass
- 846.66549838
Overview
Undecaprenyl phosphate is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).
Names & identifiers
- Preferred name
- Undecaprenyl phosphate
- IUPAC
- 3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaenyl dihydrogen phosphate
Names & synonyms
undecaprenyl phosphateDTXSID90131436625126-51-6RefChem:933807CHEBI:27193DTXCID301744167((3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl)oxy)phosphonic acid3,7,11,15,19,23,27,31,35,39,43-Undecamethyl-2,6,10,14,18,22,26,30,34,38,42-tetratetracontaun decaen-1-ol, dihydrogen phosphate3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E,42-undecaen-1-yl phosphate3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl dihydrogen phosphateUndecaprenyl-MPDA72983-15-4
Database identifiers
- CAS
25126-51-6- PubChem CID
- 1173
- DTXSID
DTXSID901314366
Properties
Computed structural properties
- XLogP
- 18.5
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 33
- Heavy atoms
- 60
- Formal charge
- 0
- Complexity
- 1,600
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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