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Aganepag

CAT: 0931-T14139-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T14139-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
910562-18-4
Target
Prostaglandin Receptor
Related Pathways
Immunology/Inflammation, GPCR/G Protein
Bioactivity
Aganepag, a potent Prostanoid EP2 receptor agonist, exhibits remarkable selectivity with an EC50 of 0.19 nM, demonstrating no activity at the EP4 receptor. Its applications are primarily in the fields of wound healing, scar reduction, scar prevention, and the treatment and prevention of wrinkles.
Smiles
CCCCC[C@H](O)c1ccc(cc1)N1[C@@H](CCCc2ccc(s2)C(O)=O)CCC1=O
Molecular Formula
C24H31NO4S
Molecular Weight
429.57
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Aganepag
CAS Number910562-18-4
PubChem CID24759922
IUPAC Name5-[3-[(2S)-1-[4-[(1S)-1-hydroxyhexyl]phenyl]-5-oxopyrrolidin-2-yl]propyl]thiophene-2-carboxylic acid
Molecular FormulaC24H31NO4S
Molecular Weight429.6
XLogP5.1
Topological Polar Surface Area106
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Heavy Atom Count30
Formal Charge0
Complexity563
SMILES
CCCCC[C@@H](C1=CC=C(C=C1)N2[C@H](CCC2=O)CCCC3=CC=C(S3)C(=O)O)O
InChI
InChI=1S/C24H31NO4S/c1-2-3-4-8-21(26)17-9-11-19(12-10-17)25-18(13-16-23(25)27)6-5-7-20-14-15-22(30-20)24(28)29/h9-12,14-15,18,21,26H,2-8,13,16H2,1H3,(H,28,29)/t18-,21-/m0/s1
InChIKey
WXWCSPFQIXPFLD-RXVVDRJESA-N
Chemical Structure
2D Structure
2D structure of Aganepag
CAS: 910562-18-4
CID: 24759922
Formula: C24H31NO4S
MW: 429.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight429.6
XLogP35.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Exact Mass429.19737964
Monoisotopic Mass429.19737964
Topological Polar Surface Area106 Ų
Heavy Atom Count30
Formal Charge0
Complexity563
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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BA5726-1Aganepag
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A20794-100Aganepag 100mg

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