Structure Database (LMSD)

HO OH
Common Name
Campherene-2,13-diol
Systematic Name
Synonyms
LM ID
LMPR0103800001
Formula
C15H26O2
Exact Mass
Calculate m/z
238.19328
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]
C15 isoprenoids (sesquiterpenes) [PR0103]
Campherenane and santalane sesquiterpenoids [PR010380]

String Representations

InChiKey (Click to copy)
FUCSWNUANQRDFQ-WZUFQYTHSA-N
InChi (Click to copy)
InChI=1S/C15H26O2/c1-11(10-16)5-4-7-14(2)12-6-8-15(14,3)13(17)9-12/h5,12-13,16-17H,4,6-10H2,1-3H3/b11-5-
SMILES (Click to copy)
C1(O)CC2C(C)(CC/C=C(\CO)/C)C1(C)CC2

References

Other Databases

PubChem CID
42608198

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 2
Aromatic Rings 0
Rotatable Bonds 4
Van der Waals Molecular Volume 258.28
Topological Polar Surface Area 40.46
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 2
logP 3.46
Molar Refractivity 70.64

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Created at
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Updated at
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