Structure Database (LMSD)
Common Name
cycloartanol
Systematic Name
9β,19-cyclo-lanostan-3β-ol
Synonyms
No other lipid differing only in stereochemistry/bond geometry found
3D model of cycloartanol
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)
YABASAWVVRQMEU-YBXTVTTCSA-N
InChi (Click to copy)
InChI=1S/C30H52O/c1-20(2)9-8-10-21(3)22-13-15-28(7)24-12-11-23-26(4,5)25(31)14-16-29(23)19-30(24,29)18-17-27(22,28)6/h20-25,31H,8-19H2,1-7H3/t21-,22-,23+,24+,25+,27-,28+,29-,30+/m1/s1
SMILES (Click to copy)
C1C[C@@]23C[C@]42CC[C@H](O)C(C)(C)[C@]4([H])CC[C@@]3([H])[C@]2(C)CC[C@]([H])([C@@](C)([H])CCCC(C)C)[C@@]12C
References
Calculated Physicochemical Properties
Heavy Atoms
31
Rings
5
Aromatic Rings
0
Rotatable Bonds
5
Van der Waals Molecular Volume
474.55
Topological Polar Surface Area
20.23
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
logP
8.54
Molar Refractivity
131.26
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Created at
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Updated at
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