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20-ethyl Prostaglandin E2

CAT: 0024-sc-205099ASize: 5 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-205099ASize:5 mg
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CAS Number
37492-24-3

Chemical Information

20a,20b-dihomo-9-oxo-11R,15S-dihydroxy-5Z,13E-prostadienoic acid

20-Ethyl-PGE2 is a prostanoid.

CAS Number37492-24-3
PubChem CID16061106
IUPAC Name(Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxydec-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
Molecular FormulaC22H36O5
Molecular Weight380.5
XLogP3.9
Topological Polar Surface Area94.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count14
Heavy Atom Count27
Formal Charge0
Complexity497
SMILES
CCCCCCC[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O)O
InChI
InChI=1S/C22H36O5/c1-2-3-4-5-8-11-17(23)14-15-19-18(20(24)16-21(19)25)12-9-6-7-10-13-22(26)27/h6,9,14-15,17-19,21,23,25H,2-5,7-8,10-13,16H2,1H3,(H,26,27)/b9-6-,15-14+/t17-,18+,19+,21+/m0/s1
InChIKey
NXMMZTNQIJBMBC-QKIVIXBWSA-N
Chemical Structure
2D Structure
2D structure of 20a,20b-dihomo-9-oxo-11R,15S-dihydroxy-5Z,13E-prostadienoic acid
CAS: 37492-24-3
CID: 16061106
Formula: C22H36O5
MW: 380.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight380.5
XLogP33.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count14
Exact Mass380.25627424
Monoisotopic Mass380.25627424
Topological Polar Surface Area94.8 Ų
Heavy Atom Count27
Formal Charge0
Complexity497
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
T208830-0120-ethyl Prostaglandin F2α
T84651-0120-ethyl Prostaglandin E2
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RM-P151480-01Prostaglandin Impurity 20
MBS579864320-hydroxy Prostaglandin F2alpha
HY-13741420-Hydroxy Prostaglandin E2
GTR19222613-0120-hydroxy Prostaglandin F2α
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