Cas no 363-22-4 (Prost-5-en-1-oic acid,11,15-dihydroxy-9-oxo-, (5Z,11a,15S)-)
363-22-4 structure
Product Name:Prost-5-en-1-oic acid,11,15-dihydroxy-9-oxo-, (5Z,11a,15S)-
Prost-5-en-1-oic acid,11,15-dihydroxy-9-oxo-, (5Z,11a,15S)- Chemical and Physical Properties
Names and Identifiers
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- Prost-5-en-1-oic acid,11,15-dihydroxy-9-oxo-, (5Z,11a,15S)-
- (Z)-7-[(1R,2R,3R)-3-hydroxy-2-[(3S)-3-hydroxyoctyl]-5-oxocyclopentyl]hept-5-enoic acid
- SCHEMBL16691829
- 13,14-Dihydroprostaglandin E2
- 13,14-Dihydro-PGE2
- 363-22-4
- U 42170
- U-42170
- Prost-5-en-1-oic acid, 11,15-dihydroxy-9-oxo-, (5Z,11alpha,15S)-
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- 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/h4,7,15-17,19,21,23H,2-3,5-6,8-14H2,1H3,(H,24,25)/b7-4-/t15-,16+,17+,19+/m0/s1
- InChI Key： PSUXJJCBYWUFQC-KSNMPCKYSA-N
- SMILES： O[C@@H]1CC([C@H](C/C=C\CCCC(=O)O)[C@H]1CC[C@H](CCCCC)O)=O
Computed Properties
- Exact Mass: 354.24072
- Monoisotopic Mass: 354.24062418g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 25
- Rotatable Bond Count: 13
- Complexity: 432
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 94.8?2
Experimental Properties
- PSA: 94.83
Prost-5-en-1-oic acid,11,15-dihydroxy-9-oxo-, (5Z,11a,15S)- Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
363-22-4 (Prost-5-en-1-oic acid,11,15-dihydroxy-9-oxo-, (5Z,11a,15S)-) Related Products
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