7-[3-hydroxy-2-[(E)-3-hydroxy-3-methylnon-1-enyl]-5-oxocyclopentyl]heptanoic acid
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7-[3-hydroxy-2-[(E)-3-hydroxy-3-methylnon-1-enyl]-5-oxocyclopentyl]heptanoic acid
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CAS No:
144730-92-7
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Formula:
C22H38O5
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Chemical Name:
7-[3-hydroxy-2-[(E)-3-hydroxy-3-methylnon-1-enyl]-5-oxocyclopentyl]heptanoic acid
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Synonyms:
15,20-Dimethyl-PGE1;
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CAS No:
7-[3-hydroxy-2-[(E)-3-hydroxy-3-methylnon-1-enyl]-5-oxocyclopentyl]heptanoic acid Basic Attributes
382.53400
382.27192431
Characteristics
94.83000
4.25530
1.105g/cm3
88 - 89 °C
545.5ºC at 760mmHg
297.8ºC
1.539
3.57E-14mmHg at 25°C
Computed Properties
Molecular Weight:382.5
XLogP3:3.9
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:14
Exact Mass:382.27192431
Monoisotopic Mass:382.27192431
Topological Polar Surface Area:94.8
Heavy Atom Count:27
Complexity:487
Undefined Atom Stereocenter Count:4
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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