POV-PC

CAT: 0931-T35580-04Size: 25 mgDry Ice: NoHazardous: No

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CAT#:0931-T35580-04Size:25 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

121324-31-0

Target

Apoptosis

Related Pathways

Apoptosis

Bioactivity

POV-PC is an oxidized phospholipid that inhibits VSMC growth under high serum conditions and induces apoptosis under low serum conditions. POVPC reduces NO production and expression of CD31 and endothelial NOS, triggering ferroptosis in vascular smooth muscle cells, promoting vascular calcification.

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

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

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 Number	121324-31-0
PubChem CID	23557187
IUPAC Name	[(2R)-3-hexadecanoyloxy-2-(5-oxopentanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Formula	C29H56NO9P
Molecular Weight	593.7
XLogP	5.9
Topological Polar Surface Area	128
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	30
Heavy Atom Count	40
Formal Charge	0
Complexity	704

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

CAS: 121324-31-0

CID: 23557187

Formula: C29H56NO9P

MW: 593.7

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	593.7
XLogP3	5.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	30
Exact Mass	593.36926936
Monoisotopic Mass	593.36926936
Topological Polar Surface Area	128 Å²
Heavy Atom Count	40
Formal Charge	0
Complexity	704
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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