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19 (R) -Hydroxy-prostaglandin E2

CAT: 0024-sc-201252Size: 50 µgDry Ice: NoHazardous: No
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CAT#:0024-sc-201252Size:50 µg
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CAS Number
64625-54-3

Chemical Information

19(R)-OH-Pge2

19R-Hydroxy-PGE2 is a prostanoid.

CAS Number64625-54-3
PubChem CID5283038
IUPAC Name(Z)-7-[(1R,2R,3R)-2-[(E,3S,7R)-3,7-dihydroxyoct-1-enyl]-3-hydroxy-5-oxocyclopentyl]hept-5-enoic acid
Molecular FormulaC20H32O6
Molecular Weight368.5
XLogP1.3
Topological Polar Surface Area115
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count12
Heavy Atom Count26
Formal Charge0
Complexity499
SMILES
C[C@H](CCC[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1C/C=C\CCCC(=O)O)O)O)O
InChI
InChI=1S/C20H32O6/c1-14(21)7-6-8-15(22)11-12-17-16(18(23)13-19(17)24)9-4-2-3-5-10-20(25)26/h2,4,11-12,14-17,19,21-22,24H,3,5-10,13H2,1H3,(H,25,26)/b4-2-,12-11+/t14-,15+,16-,17-,19-/m1/s1
InChIKey
WTJYDBMHYPQFNJ-ZUVVJKHESA-N
Chemical Structure
2D Structure
2D structure of 19(R)-OH-Pge2
CAS: 64625-54-3
CID: 5283038
Formula: C20H32O6
MW: 368.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight368.5
XLogP31.3
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count12
Exact Mass368.21988874
Monoisotopic Mass368.21988874
Topological Polar Surface Area115 Ų
Heavy Atom Count26
Formal Charge0
Complexity499
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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