Cas no 68555-08-8 (beta-Sitosterol)
beta-Sitosterol structure
Product Name:beta-Sitosterol
beta-Sitosterol Chemical and Physical Properties
Names and Identifiers
-
- Steroids,hydroxy
- (24S)-5,22-STIGMASTADIEN-3BETA-OL
- 3BETA-HYDROXY-24-ETHYL-5,22-CHOLESTADIENE
- [3B-HYDROXY-24-ETHYL-D] ZZ-CHOLESTADIENE
- 5,22-CHOLESTADIEN-24BETA-ETHYL-3BETA-OL
- 5,22-CHOLESTADIEN-24B-ETHYL-3BETA-OL
- 5,22-STIGMASTADIEN-3-BETA-OL
- Refinedsoysterol
- Soybeanoilsterolsphytosterols
- Stigmasterol
- UNII-PL360EPO9J
- (24R)-Stigmast-5-en-3.beta.-ol
- 5-Cholesten-24.beta.-ethyl-3.beta.-ol
- (-)-.beta.-Sitosterol
- SCHEMBL3963390
- .beta.-Sitosterin
- 68555-08-8
- 949109-75-5
- AC-11208
- Stigmast-5-en-3.beta.-ol
- NS00123049
- (3.beta.)-Stigmast-5-en-3-ol #
- AKOS021602260
- AKOS001581066
- .beta.-Sitosterol
- KZJWDPNRJALLNS-UHFFFAOYSA-N
- (24R)-Ethylcholest-5-en-3.beta.-ol
- LS-15272
- .DELTA.5-Stigmasten-3.beta.-ol
- 17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
- Stigmast-5-en-3-ol, (3.beta.)-
- Q121802
- 1-(5-ETHYL-6-METHYLHEPTAN-2-YL)-9A,11A-DIMETHYL-1H,2H,3H,3AH,3BH,4H,6H,7H,8H,9H,9AH,9BH,10H,11H,11AH-CYCLOPENTA[A]PHENANTHREN-7-OL
- FT-0773035
- 24.alpha.-Ethylcholesterol
- Refined soy sterol
- Soybean oil sterols phytosterols
- beta-Sitosterol
-
- Inchi: 1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3
- InChI Key: KZJWDPNRJALLNS-UHFFFAOYSA-N
- SMILES: CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
Computed Properties
- Exact Mass: 414.386
- Monoisotopic Mass: 414.386
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 30
- Rotatable Bond Count: 6
- Complexity: 634
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 9
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 20.2A^2
- XLogP3: 9.3
Experimental Properties
- Color/Form: White solid
- Density: 0.97 g/cm3
- Melting Point: 165-167?°C(lit.)
- Boiling Point: 501.9oC at 760 mmHg
- Flash Point: 220.4oC
- Refractive Index: 1.519
- PSA: 20.23000
- LogP: 8.02480
- Specific Rotation: -28 o (C=2, CHCL3)
beta-Sitosterol Security Information
- WGK Germany:3
- Safety Instruction: 22-24/25
- Storage Condition:20°C
beta-Sitosterol Related Literature
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
-
Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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