Structure Database (LMSD)
Common Name
4,4-dimethyl-5alpha-cholest-7-en-3beta-ol
Systematic Name
4,4-dimethyl-5α-cholest-7-en-3β-ol
Synonyms
- 4,4-Dimethyl-5alpha-cholest-7-en-3beta-ol
- 4,4-dimethyl-5alpha-cholest-7-en-3beta-ol
3D model of 4,4-dimethyl-5alpha-cholest-7-en-3beta-ol
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
UVNXFLZMQCAWCP-RCTKLBHESA-N
InChi (Click to copy)
InChI=1S/C29H50O/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)26(30)16-18-29(25,7)24(21)15-17-28(22,23)6/h11,19-20,22-26,30H,8-10,12-18H2,1-7H3/t20-,22-,23+,24+,25+,26+,28-,29-/m1/s1
SMILES (Click to copy)
[C@]12([H])CC[C@]3(C)[C@]([H])(CC[C@@]3([H])C1=CC[C@@]1([H])C(C)(C)[C@H](CC[C@]21C)O)[C@]([H])(C)CCCC(C)C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
30
Rings
4
Aromatic Rings
0
Rotatable Bonds
5
Van der Waals Molecular Volume
466.97
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
8.31
Molar Refractivity
128.73
Admin
Created at
-
Updated at
-