Structure Database (LMSD)
Common Name
Delta 8,14 -Sterol
Systematic Name
4α-methyl-5α-ergosta-8,14,24(28)-trien-3β-ol
Synonyms
3D model of Delta 8,14 -Sterol
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
HLAWVOWADPNAGN-BAHZUFOISA-N
InChi (Click to copy)
InChI=1S/C29H46O/c1-18(2)19(3)8-9-20(4)23-12-13-25-22-10-11-24-21(5)27(30)15-17-29(24,7)26(22)14-16-28(23,25)6/h13,18,20-21,23-24,27,30H,3,8-12,14-17H2,1-2,4-7H3/t20-,21+,23-,24+,27+,28-,29+/m1/s1
SMILES (Click to copy)
C12CC[C@@]3([H])[C@H](C)[C@@H](O)CC[C@]3(C)C=1CC[C@]1(C)[C@@]([H])([C@]([H])(C)CCC(=C)C(C)C)CC=C21
References
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
30
Rings
4
Aromatic Rings
0
Rotatable Bonds
5
Van der Waals Molecular Volume
461.69
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
8.15
Molar Refractivity
128.68
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Created at
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Updated at
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