Structure Database (LMSD)

Common Name
(-)-endo-Fenchol
Systematic Name
Synonyms
LM ID
LMPR0102120005
Formula
Exact Mass
Calculate m/z
154.135765
Status
Active

Classification

String Representations

InChiKey (Click to copy)
IAIHUHQCLTYTSF-MRTMQBJTSA-N
InChi (Click to copy)
InChI=1S/C10H18O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7-8,11H,4-6H2,1-3H3/t7-,8-,10+/m1/s1
SMILES (Click to copy)
[C@@]12(C)CC[C@@H](C(C)(C)[C@H]1O)C2

Other Databases

KEGG ID
CHEBI ID
PubChem CID

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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