Cas no 128523-04-6 (Cholestan-6-one,3,14,25-trihydroxy-, (3b,5b,8a)- (9CI))
128523-04-6 structure
Product Name:Cholestan-6-one,3,14,25-trihydroxy-, (3b,5b,8a)- (9CI)
CAS No:128523-04-6
MF:C27H46O4
MW:434.651749134064
CID:175105
Update Time:2024-01-25
Cholestan-6-one,3,14,25-trihydroxy-, (3b,5b,8a)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Cholestan-6-one,3,14,25-trihydroxy-, (3b,5b,8a)- (9CI)
- (+)-Tordanone
- Tordanone
-
- Inchi： 1S/C27H46O4/c1-17(7-6-11-24(2,3)30)19-10-14-27(31)21-16-23(29)22-15-18(28)8-12-25(22,4)20(21)9-13-26(19,27)5/h17-22,28,30-31H,6-16H2,1-5H3/t17-,18+,19-,20+,21+,22+,25-,26-,27?/m1/s1
- InChI Key： RSSKEVMPAXYAOM-FKKNELGYSA-N
- SMILES： [C@@H]1(O)C[C@]2([H])[C@](C)(CC1)[C@]1([H])[C@@]([H])(C3(O)[C@@](CC1)(C)[C@@H]([C@H](C)CCCC(O)(C)C)CC3)CC2=O
Computed Properties
- Exact Mass: 272.08309
Experimental Properties
- PSA: 52.54
Cholestan-6-one,3,14,25-trihydroxy-, (3b,5b,8a)- (9CI) Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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