RefMet Compound Details

MW structure50058 (View MW Metabolite Database details)
RefMet nametrans-Carveol
Systematic name(1R,5S)-2-methyl-5-(prop-1-en-2-yl)cyclohex-2-en-1-ol
SMILESC=C(C)[C@H]1CC=C(C)[C@@H](C1)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass152.120115 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC10H16OView other entries in RefMet with this formula
InChIInChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-11H,1,5-6H2,2-3H3/t9-,10+/m0/s1
InChIKeyBAVONGHXFVOKBV-VHSXEESVSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassPrenol Lipids
Main ClassIsoprenoids
Sub ClassC10 isoprenoids
Pubchem CID443178
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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