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15 (R) -Prostaglandin E1

CAT: 0926-BP183529Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0926-BP183529Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
20897-91-0
Smiles
C (CCCCCC (O) =O) [C@@H]1[C@@H] (/C=C/[C@@H] (CCCCC) O) [C@H] (O) CC1=O
Molecular Formula
C20H34O5
Molecular Weight
354.48 g/mol
Controlled
No

Chemical Information

15-Epiprostaglandin E1

15(R)-PGE1 is a prostanoid.

CAS Number20897-91-0
PubChem CID5283056
IUPAC Name7-[(1R,2R,3R)-3-hydroxy-2-[(E,3R)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]heptanoic acid
Molecular FormulaC20H34O5
Molecular Weight354.5
XLogP3.2
Topological Polar Surface Area94.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Heavy Atom Count25
Formal Charge0
Complexity432
SMILES
CCCCC[C@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CCCCCCC(=O)O)O)O
InChI
InChI=1S/C20H34O5/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/h12-13,15-17,19,21,23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16-,17-,19-/m1/s1
InChIKey
GMVPRGQOIOIIMI-CHCORRSHSA-N
Chemical Structure
2D Structure
2D structure of 15-Epiprostaglandin E1
CAS: 20897-91-0
CID: 5283056
Formula: C20H34O5
MW: 354.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight354.5
XLogP33.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Exact Mass354.24062418
Monoisotopic Mass354.24062418
Topological Polar Surface Area94.8 Ų
Heavy Atom Count25
Formal Charge0
Complexity432
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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AG184Prostaglandin
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