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Prostaglandin K1

CAT: 0013-GTR19241521-01Size: 100 µgDry Ice: NoHazardous: No
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CAT#:0013-GTR19241521-01Size:100 µg
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Description
Prostaglandin K1 (compound 46) is a synthetic prostanoid analog exhibiting an EC50 and Ki of 2800 nM at the EP1 receptor. This tool compound is utilized in vitro to investigate EP1 receptor signaling and its role in physiological processes such as pain perception and smooth muscle contraction.
CAS Number
69413-73-6
Field of Research
Immunology & Inflammation, Pharmacology & Drug Discovery
Smiles
C (CCCCCC (O) =O) [C@@H]1[C@@H] (/C=C/[C@H] (CCCCC) O) C (=O) CC1=O
Molecular Formula
C20H32O5
Molecular Weight
352.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Prostaglandin K1

PGK1 is a prostanoid.

CAS Number69413-73-6
PubChem CID16061102
IUPAC Name7-[(1R,2R)-2-[(E,3S)-3-hydroxyoct-1-enyl]-3,5-dioxocyclopentyl]heptanoic acid
Molecular FormulaC20H32O5
Molecular Weight352.5
XLogP3.7
Topological Polar Surface Area91.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Heavy Atom Count25
Formal Charge0
Complexity469
SMILES
CCCCC[C@@H](/C=C/[C@@H]1[C@H](C(=O)CC1=O)CCCCCCC(=O)O)O
InChI
InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h12-13,15-17,21H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16+,17+/m0/s1
InChIKey
KJWZYMMLVHIVSU-IYCNHOCDSA-N
Chemical Structure
2D Structure
2D structure of Prostaglandin K1
CAS: 69413-73-6
CID: 16061102
Formula: C20H32O5
MW: 352.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight352.5
XLogP33.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Exact Mass352.22497412
Monoisotopic Mass352.22497412
Topological Polar Surface Area91.7 Ų
Heavy Atom Count25
Formal Charge0
Complexity469
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
TBI4534-5MGProstaglandin B1, Endogenous prostaglandin
TBI4461-5MGProstaglandin A1, Endogenous prostaglandin
TBI4455-10MGProstaglandin E1, Endogenous prostaglandin
AG184Prostaglandin
TBI1358-1MGProstaglandin E2, Prostaglandin E (EP) agonist
TBZ1840Prostaglandin B1
HY-120656-01Prostaglandin K2
HY-126819Prostaglandin H1
HY-116778-01Prostaglandin G2
TCL-00194-01Prostaglandin G1

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