Cas no 511-64-8 (9,19-Cyclolanostane)
9,19-Cyclolanostane structure
Product Name:9,19-Cyclolanostane
9,19-Cyclolanostane Chemical and Physical Properties
Names and Identifiers
-
- 9,19-Cyclolanostane
- Cycloartane
- Cycloartane100μg
- Cycloorthane
- 4,4,14-trimethyl-9,19-cyclo-5alpha,9beta-cholestane
- UNII-TJ8JF2M6U6
- 9beta,19-cyclolanostane
- 1H,19H-CYCLOPROPA(9,10)CYCLOPENTA(A)PHENANTHRENE, 17-(1,5-DIMETHYLHEXYL)TETRADECAHYDRO-4,4,13,14-TETRAMETHYL-, (5S-(5.ALPHA.,8.BETA.,9R*,10S*,13.BETA.,14.ALPHA.,17.BETA.(S*))-
- CHEBI:37778
- 9,19-CYCLO-9.BETA.-LANOSTANE
- (1S,3R,8S,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methylheptan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecane
- (5S-(5.ALPHA.,8.BETA.,9R*,10S*,13.BETA.,14.ALPHA.,17.BETA.(S*)))-17-(1,5-DIMETHYLHEXYL)TETRADECAHYDRO-4,4,13,14-TETRAMETHYL-1H,19H-CYCLOPROPA(9,10)CYCLOPENTA(A)PHENANTHRENE
- DTXSID10965378
- TJ8JF2M6U6
- 511-64-8
- Q27117259
-
- Inchi： 1S/C30H52/c1-21(2)10-8-11-22(3)23-14-17-28(7)25-13-12-24-26(4,5)15-9-16-29(24)20-30(25,29)19-18-27(23,28)6/h21-25H,8-20H2,1-7H3/t22-,23-,24+,25+,27-,28+,29-,30+/m1/s1
- InChI Key： BSLYZLYLUUIFGZ-JRUDBKCSSA-N
- SMILES： [C@@]123CC[C@]4(C)[C@@H]([C@H](C)CCCC(C)C)CC[C@@]4(C)[C@@H]1CC[C@H]1C(C)(C)CCC[C@]21C3
Computed Properties
- Exact Mass: 412.40700
- Monoisotopic Mass: 412.406901659g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 30
- Rotatable Bond Count: 5
- Complexity: 674
- 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: 11.8
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0.00000
- LogP: 9.27800
9,19-Cyclolanostane Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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