Structure database (LMSD)

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LM IDLMPR0102090048
Common Name(4R)-limonene 1α,2α-epoxide
Systematic Name(1S,4R,6R)-1-methyl-4-(prop-1-en-2-yl)-7-oxabicyclo[4.1.0]heptane
Synonyms(+)-trans-limonene oxide;(1S,4R,6R)-4-isopropenyl-1-methyl-7-
oxabicyclo[4.1.0]heptane; 1α,2α-epoxy-4βH-p-menth-8-ene; D-LIMONENE 1,2-
EPOXIDE
Exact Mass
152.1201 (neutral)    Calculate m/z:
FormulaC10H16O
CategoryPrenol Lipids [PR]
Main ClassIsoprenoids [PR01]
Sub ClassC10 isoprenoids (monoterpenes) [PR0102]
Class Level 4Menthane monoterpenoids [PR010209]
PubChem CID449290
CHEBI ID43812
InChIKeyCCEFMUBVSUDRLG-BBBLOLIVSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C10H16O/c1-7(2)8-4-5-10(3)9(6-8)11-10/h8-9H,1,4-6H2,2-3H3/t8-,9-,10+/m1
/s1
SMILESC1[C@@]2(O[C@]2([H])C[C@]([H])(C(=C)C)C1)C
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms11Rings2Aromatic Rings0Rotatable Bonds1
 van der Waals
Molecular Volume
162.99Topological Polar
Surface Area
12.53Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
1
 logP3.09Molar
Refractivity
46.46