Structure Database (LMSD)
Common Name
vetispiradiene
Systematic Name
(2S,5S,10R)-6,10-dimethyl-2-(prop-1-en-2-yl)spiro[4.5]dec-6-ene
Synonyms
- vetispiradiene
No other lipid differing only in stereochemistry/bond geometry found
3D model of vetispiradiene
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
Level 4 Class
String Representations
InChiKey (Click to copy)
WEZDOYDDKIHCLM-QLFBSQMISA-N
InChi (Click to copy)
InChI=1S/C15H24/c1-11(2)14-8-9-15(10-14)12(3)6-5-7-13(15)4/h6,13-14H,1,5,7-10H2,2-4H3/t13-,14+,15-/m1/s1
SMILES (Click to copy)
C1CC[C@@H](C)[C@]2(C[C@@H](C(=C)C)CC2)C=1C
References
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
2
Aromatic Rings
0
Rotatable Bonds
1
Van der Waals Molecular Volume
238.06
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
logP
4.73
Molar Refractivity
66.74
Admin
Created at
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Updated at
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