1-Dodecanoyl-sn-glycerol 3-phosphate
PubChem CID
71296161
Structure
Molecular Formula
Synonyms
- 1-lauroyl-sn-glycerol 3-phosphate(2-)
- 1-dodecanoyl-sn-glycerol 3-phosphate
- CHEBI:72682
- (2R)-3-(dodecanoyloxy)-2-hydroxypropyl phosphate
- Q27140075
Molecular Weight
352.36 g/mol
Computed by PubChem 2.1 (PubChem release 2021.05.07)
Parent Compound
Dates
- Create:2013-04-03
- Modify:2025-01-25
Description
1-lauroyl-sn-glycerol 3-phosphate(2-) is an anionic phospholipid obtained by deprotonation of the phosphate OH groups of 1-lauroyl-sn-glycerol 3-phosphate. It is an anionic phospholipid and a 1-acyl-sn-glycerol 3-phosphate(2-). It is a conjugate base of a 1-lauroyl-sn-glycerol 3-phosphate.
1-Dodecanoyl-sn-glycerol 3-phosphate is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).
Chemical Structure Depiction
Conformer generation is disallowed since too flexible
[(2R)-3-dodecanoyloxy-2-hydroxypropyl] phosphate
Computed by LexiChem 2.6.6 (PubChem release 2019.06.18)
InChI=1S/C15H31O7P/c1-2-3-4-5-6-7-8-9-10-11-15(17)21-12-14(16)13-22-23(18,19)20/h14,16H,2-13H2,1H3,(H2,18,19,20)/p-2/t14-/m1/s1
Computed by InChI 1.0.5 (PubChem release 2019.06.18)
STTKJLVEXMKLNA-CQSZACIVSA-L
Computed by InChI 1.0.5 (PubChem release 2019.06.18)
CCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])O
Computed by OEChem 2.3.0 (PubChem release 2024.12.12)
C15H29O7P-2
Computed by PubChem 2.1 (PubChem release 2019.06.18)
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
352.36 g/mol
Reference
Computed by PubChem 2.1 (PubChem release 2021.05.07)
Property Name
XLogP3-AA
Property Value
2.7
Reference
Computed by XLogP3 3.0 (PubChem release 2019.06.18)
Property Name
Hydrogen Bond Donor Count
Property Value
1
Reference
Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Property Name
Hydrogen Bond Acceptor Count
Property Value
7
Reference
Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Property Name
Rotatable Bond Count
Property Value
15
Reference
Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Property Name
Exact Mass
Property Value
352.16509026 Da
Reference
Computed by PubChem 2.1 (PubChem release 2021.05.07)
Property Name
Monoisotopic Mass
Property Value
352.16509026 Da
Reference
Computed by PubChem 2.1 (PubChem release 2021.05.07)
Property Name
Topological Polar Surface Area
Property Value
119 Ų
Reference
Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Property Name
Heavy Atom Count
Property Value
23
Reference
Computed by PubChem
Property Name
Formal Charge
Property Value
-2
Reference
Computed by PubChem
Property Name
Complexity
Property Value
331
Reference
Computed by Cactvs 3.4.6.11 (PubChem release 2019.06.18)
Property Name
Isotope Atom Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Atom Stereocenter Count
Property Value
1
Reference
Computed by PubChem
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Defined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Reference
Computed by PubChem
Property Name
Covalently-Bonded Unit Count
Property Value
1
Reference
Computed by PubChem
Property Name
Compound Is Canonicalized
Property Value
Yes
Reference
Computed by PubChem (release 2012.11.26)
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Same Parent, Connectivity Count
Same Parent, Exact Count
Mixtures, Components, and Neutralized Forms Count
Similar Compounds (2D)
Similar Conformers (3D)
Same Count
- ChEBI1-lauroyl-sn-glycerol 3-phosphate(2-)https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:72682
- E. coli Metabolome Database (ECMDB)
- Rhea - Annotated Reactions DatabaseLICENSERhea has chosen to apply the Creative Commons Attribution License (http://creativecommons.org/licenses/by/4.0/). This means that you are free to copy, distribute, display and make commercial use of the database in all legislations, provided you credit (cite) Rhea.https://www.rhea-db.org/help/license-disclaimer
- Wikidata1-lauroyl-sn-glycerol 3-phosphate(2-)https://www.wikidata.org/wiki/Q27140075
- PubChem
- MolGenieMolGenie Organic Chemistry Ontologyhttps://github.com/MolGenie/ontology/
CONTENTS