Structure database (LMSD)

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LM IDLMPR0102120048
Common Name(+)-exo-5-hydroxycamphor
Systematic Name(1R,4R,5R)-5-hydroxy-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
Synonyms(+)-exo-5-Hydroxycamphor;(+)-exo-5-hydroxycamphor; 5-EXO-HYDROXYCAMPHOR
Exact Mass
168.1150 (neutral)    Calculate m/z:
FormulaC10H16O2
CategoryPrenol Lipids [PR]
Main ClassIsoprenoids [PR01]
Sub ClassC10 isoprenoids (monoterpenes) [PR0102]
Class Level 4Bicyclic monoterpenoids [PR010212]
PubChem CID447414
KEGG IDC03448
CHEBI ID15398
InChIKeyDJQYBVLXBVJHMU-PJKMHFRUSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C10H16O2/c1-9(2)6-4-8(12)10(9,3)5-7(6)11/h6-7,11H,4-5H2,1-3H3/t6-,7+,10-/m0/s1
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SMILES
C1C(=O)[C@]2(C(C)(C)[C@@]1([C@H](O)C2)[H])C
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms12Rings2Aromatic Rings0Rotatable Bonds0
 van der Waals
Molecular Volume
171.78Topological Polar
Surface Area
37.30Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
2
 logP1.66Molar
Refractivity
46.14