Basic information
- CAS
64199-61-7- Standard SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCCCCCCCCC- InChIKey
DOZKMFVMCATMEH-OZKTZCCCSA-N- Molecular formula
- C37H70O5
- Average molar mass
- 594.9 g/mol
- Monoisotopic mass
- 594.52232533
Overview
1-oleoyl-2-palmitoyl-sn-glycerol is a 1,2-diacyl-sn-glycerol in which the 1- and 2-acyl groups are specified as oleoyl and palmitoyl respectively. It is a 1,2-diacyl-sn-glycerol and a 1-oleoyl-2-palmitoylglycerol.
Names & identifiers
- Preferred name
- DG(18:1(9Z)/16:0/0:0)
- IUPAC
- [(2S)-2-hexadecanoyloxy-3-hydroxypropyl] (Z)-octadec-9-enoate
Names & synonyms
(2S)-2-(hexadecanoyloxy)-3-hydroxypropyl (9Z)-octadec-9-enoateDG(18:1(9Z)/16:0/0:0)RefChem:9378511-oleoyl-2-palmitoyl-sn-glycerol1-(9Z-octadecenoyl)-2-hexadecanoyl-sn-glycerol[(2S)-2-hexadecanoyloxy-3-hydroxypropyl] (Z)-octadec-9-enoateLMGL0201000564199-61-71-oleoyl-2-palmitoyl-glycerolSCHEMBL7918252CHEBI:754471-oleoyl,2-palmitoyl-sn-glycerol
Show more names
Diacylglycerol(18:1n9/16:0)Diacylglycerol(18:1w9/16:0)DTXSID9011698201-O-oleoyl-2-O-palmitoyl-sn-glycerolDAG(18:1n9/16:0)DAG(18:1w9/16:0)DG(18:1n9/16:0)DG(18:1w9/16:0)
Database identifiers
- CAS
64199-61-7- PubChem CID
- 5283471
- DTXSID
DTXSID901169820- ChEBI
CHEBI:75447- Nikkaji
- J2.296.558A
Properties
Computed structural properties
- XLogP
- 14.2
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 35
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 603
Experimental & physicochemical properties
Lipids
Lipids -> Ambiguous Lipids
Lipids -> Glycerolipids [GL] -> Diradylglycerols [GL02] -> Diacylglycerols [GL0201]
Physical DescriptionSolid
Collision Cross Section261.0 Ų [M+NH4]+ [CCS Type: DT; Buffer gas: N2; Sample Type: Human plasma; Dataset: Ambiguous Lipids]
Chemistry & industry
Pharmacology
Tissue LocationsAll Tissues
Cellular LocationsExtracellular
Metabolite PathwaysDe Novo Triacylglycerol Biosynthesis TG(18:1(9Z)/16:0/18:1(9Z))
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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