Cas no 1474-14-2 (Pregn-5-ene-20-carboxylicacid, 3-(acetyloxy)-, (3b,20S)-)
1474-14-2 structure
Product Name:Pregn-5-ene-20-carboxylicacid, 3-(acetyloxy)-, (3b,20S)-
Pregn-5-ene-20-carboxylicacid, 3-(acetyloxy)-, (3b,20S)- Chemical and Physical Properties
Names and Identifiers
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- Pregn-5-ene-20-carboxylicacid, 3-(acetyloxy)-, (3b,20S)-
- (2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]propanoic acid
- Acetoxybisnorcholenic acid
- Bis-nonafluorbutyl-aether
- bis-nonafluorobutyl ether
- Bisnorcholenic acid acetate
- Dinonafluorobutyl ether
- Diperfluorobutyl ether
- perfluorobutyl ether
- Perfluorodibutylether
- Perfluoro-n-dibutyl ether
- 1474-14-2
- Pregn-5-ene-20-carboxylic acid, 3-(acetyloxy)-, (3beta,20S)-
- 23,24-Bisnor-3beta-acetoxy-5beta-cholen-22-oic acid
- Pregn-5-ene-20-carboxylic acid, 3-(acetyloxy)-, (3beta,20S)-(9CI)
- NSC 224321
- 22,23-Bisnor-5-cholenic acid, 3.beta.-hydroxy, acetate(ester)
- (20S)-3beta-acetoxy-5-pregnene-20-carboxylic acid
- SCHEMBL10705970
-
- Inchi： 1S/C24H36O4/c1-14(22(26)27)19-7-8-20-18-6-5-16-13-17(28-15(2)25)9-11-23(16,3)21(18)10-12-24(19,20)4/h5,14,17-21H,6-13H2,1-4H3,(H,26,27)/t14-,17-,18-,19+,20-,21-,23-,24+/m0/s1
- InChI Key： WRMRAQBPFAXGNJ-VYIMKSKESA-N
- SMILES： O(C(C)=O)[C@H]1CC[C@@]2(C)C(C1)=CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]([C@@H](C(=O)O)C)CC[C@H]21
Computed Properties
- Exact Mass: 388.26100
- Monoisotopic Mass: 388.26135963g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 28
- Rotatable Bond Count: 4
- Complexity: 697
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 8
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.4
- Topological Polar Surface Area: 63.6?2
Experimental Properties
- PSA: 63.60000
- LogP: 5.21780
Pregn-5-ene-20-carboxylicacid, 3-(acetyloxy)-, (3b,20S)- Related Literature
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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2. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
1474-14-2 (Pregn-5-ene-20-carboxylicacid, 3-(acetyloxy)-, (3b,20S)-) Related Products
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