Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMPR0103370002
Common Name(+)-8-Drimen-7-one
Systematic Name-
Synonyms-
Exact Mass
220.1827 (neutral)    Calculate m/z:
FormulaC15H24O
CategoryPrenol Lipids [PR]
Main ClassIsoprenoids [PR01]
Sub ClassC15 isoprenoids (sesquiterpenes) [PR0103]
Class Level 4Drimane sesquiterpenoids [PR010337]
PubChem CID15761867
InChIKeyVEEZSMVXABVRFI-DZGCQCFKSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C15H24O/c1-10-11(2)15(5)8-6-7-14(3,4)13(15)9-12(10)16/h13H,6-9H2,1-5H3/
t13-,15+/m0/s1
SMILESC1C[C@]2(C)C(C)=C(C)C(=O)C[C@@]2([H])C(C)(C)C1
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms16Rings2Aromatic Rings0Rotatable Bonds0
 van der Waals
Molecular Volume
246.85Topological Polar
Surface Area
17.07Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
1
 logP4.13Molar
Refractivity
67.23