Structure database (LMSD)

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LM IDLMPR0103690002
Common Name(+)-β-Cedrene
Systematic Name-
Synonyms-
Exact Mass
204.1878 (neutral)    Calculate m/z:
FormulaC15H24
CategoryPrenol Lipids [PR]
Main ClassIsoprenoids [PR01]
Sub ClassC15 isoprenoids (sesquiterpenes) [PR0103]
Class Level 4Cedrane and isocedrane sesquiterpenoids [PR010369]
PubChem CID12302597
InChIKeyDYLPEFGBWGEFBB-YKURLNKLSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C15H24/c1-10-7-8-15-9-12(10)14(3,4)13(15)6-5-11(15)2/h11-13H,1,5-9H2,2-4H3/t11-,12?,13+,15+/m1/s1
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SMILES
[C@@]12([H])CC[C@@H](C)[C@]31CCC(=C)[C@@H](C3)C2(C)C
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms15Rings3Aromatic Rings0Rotatable Bonds0
 van der Waals
Molecular Volume
228.34Topological Polar
Surface Area
0.00Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
0
 logP4.42Molar
Refractivity
64.58