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POV-PC

CAT: 0013-GTR19192030-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19192030-01Size:1 mg
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Description
POV-PC is an oxidized phospholipid that suppresses vascular smooth muscle cell proliferation and induces apoptosis under specific serum conditions. It promotes vascular calcification by inhibiting nitric oxide production and inducing ferroptosis, making it a key molecule for studying atherosclerosis and cardiovascular disease mechanisms in vitro.
CAS Number
121324-31-0
Field of Research
Cell Biology
Smiles
[C@H] (COP (OCC[N+] (C) (C) C) (=O) [O-]) (COC (CCCCCCCCCCCCCCC) =O) OC (CCCC=O) =O
Molecular Formula
C29H56NO9P
Molecular Weight
593.73
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

PC(16:0/5:0(Cho))

1-O-palmitoyl-2-O-(5-oxovaleryl)-sn-glycero-3-phosphocholine is a 1,2-diacyl-sn-glycero-3-phosphocholine having palmitoyl and 5-oxovaleryl groups at the 1- and 2-positions respectively; major species at pH 7.3. It has a role as an apoptosis inducer. It is an aldehyde and a 1,2-diacyl-sn-glycero-3-phosphocholine. It is a conjugate base of a 1-O-palmitoyl-2-O-(5-oxovaleryl)-sn-glycero-3-phosphocholine(1+).

CAS Number121324-31-0
PubChem CID23557187
IUPAC Name[(2R)-3-hexadecanoyloxy-2-(5-oxopentanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular FormulaC29H56NO9P
Molecular Weight593.7
XLogP5.9
Topological Polar Surface Area128
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count30
Heavy Atom Count40
Formal Charge0
Complexity704
SMILES
CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCC=O
InChI
InChI=1S/C29H56NO9P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28(32)36-25-27(39-29(33)21-18-19-23-31)26-38-40(34,35)37-24-22-30(2,3)4/h23,27H,5-22,24-26H2,1-4H3/t27-/m1/s1
InChIKey
RKIDALSACBQVTN-HHHXNRCGSA-N
Chemical Structure
2D Structure
2D structure of PC(16:0/5:0(Cho))
CAS: 121324-31-0
CID: 23557187
Formula: C29H56NO9P
MW: 593.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight593.7
XLogP35.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count30
Exact Mass593.36926936
Monoisotopic Mass593.36926936
Topological Polar Surface Area128 Ų
Heavy Atom Count40
Formal Charge0
Complexity704
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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