Structure Database (LMSD)

OH H
Common Name
(-)-Borneol
Systematic Name
Synonyms
LM ID
LMPR0102120004
Formula
C10H18O
Exact Mass
Calculate m/z
154.135765
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Level 4 Class
Prenol Lipids [PR]
Isoprenoids [PR01]
C10 isoprenoids (monoterpenes) [PR0102]
Bicyclic monoterpenoids [PR010212]

String Representations

InChiKey (Click to copy)
DTGKSKDOIYIVQL-CCNFQMFXSA-N
InChi (Click to copy)
InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7?,8-,10?/m1/s1
SMILES (Click to copy)
C12(C)CCC(C[C@@]1([H])O)C2(C)C

References

Other Databases

Wikipedia
Borneol
KEGG ID
C01766
CHEBI ID
28093
PubChem CID
439569

Calculated Physicochemical Properties

Heavy Atoms 11
Rings 2
Aromatic Rings 0
Rotatable Bonds 0
Van der Waals Molecular Volume 165.63
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 2.48
Molar Refractivity 45.75

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Created at
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Updated at
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