Cas no 93368-83-3 ((3beta,5alpha,6beta,15alpha,16beta)-cholestane-3,5,6,15,16,26-hexol)
93368-83-3 structure
Product Name:(3beta,5alpha,6beta,15alpha,16beta)-cholestane-3,5,6,15,16,26-hexol
CAS No:93368-83-3
MF:C27H48O6
MW:468.666429519653
CID:1982160
PubChem ID:185255
Update Time:2025-04-21
(3beta,5alpha,6beta,15alpha,16beta)-cholestane-3,5,6,15,16,26-hexol Chemical and Physical Properties
Names and Identifiers
-
- (3beta,5alpha,6beta,15alpha,16beta)-cholestane-3,5,6,15,16,26-hexol
- 5α-Cholestane-3β,5,6β,15α,16β,26-hexaol
- Cholestane-3,5,6,15,16,26-hexol
- Cholestane-3,5,6,15,16,26-hexol, (3beta,5alpha,6beta,15alpha,16beta)-
- DTXSID50918484
- 93368-83-3
-
- Inchi： 1S/C27H48O6/c1-15(14-28)6-5-7-16(2)21-23(31)24(32)22-18-12-20(30)27(33)13-17(29)8-11-26(27,4)19(18)9-10-25(21,22)3/h15-24,28-33H,5-14H2,1-4H3/t15?,16-,17+,18-,19+,20-,21+,22-,23-,24-,25-,26-,27+/m1/s1
- InChI Key： CLNZRUHMYVMUAU-COACWXPYSA-N
- SMILES： O[C@]12C[C@H](CC[C@]1(C)[C@H]1CC[C@]3(C)[C@@H]([C@H](C)CCCC(C)CO)[C@H]([C@@H]([C@H]3[C@@H]1C[C@H]2O)O)O)O
Computed Properties
- Exact Mass: 468.345
- Monoisotopic Mass: 468.345
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 6
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 33
- Rotatable Bond Count: 6
- Complexity: 702
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 12
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.2
- Topological Polar Surface Area: 121?2
Experimental Properties
- Density: 1.213
- Boiling Point: 601.7°C at 760 mmHg
- Flash Point: 252.2°C
- Refractive Index: 1.577
(3beta,5alpha,6beta,15alpha,16beta)-cholestane-3,5,6,15,16,26-hexol Related Literature
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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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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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
Related Categories
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Steroids and steroid derivatives Hydroxy bile acids, alcohols and derivatives
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Steroids and steroid derivatives Bile acids, alcohols and derivatives Hydroxy bile acids, alcohols and derivatives
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