Structure Database (LMSD)

Common Name
gamma-Terpinene
Systematic Name
Synonyms
LM ID
LMPR0102090027
Status
Active
Exact Mass
Calculate m/z
136.1252
Formula
C10H16
Show lipids differing only in stereochemistry/bond geometry
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MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

Category
Main Class
Sub Class
Level 4 Class
Prenol Lipids [PR]
Isoprenoids [PR01]
C10 isoprenoids (monoterpenes) [PR0102]
Menthane monoterpenoids [PR010209]

String Representations

InChiKey (Click to copy)
YKFLAYDHMOASIY-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,7-8H,5-6H2,1-3H3
SMILES (Click to copy)
C1(=CCC(C)=CC1)C(C)C

References

Other Databases

Wikipedia
Terpinene
KEGG ID
C09900
HMDB ID
HMDB0005806
CHEBI ID
10577
PubChem CID
7461
Cayman ID
23722

Calculated Physicochemical Properties

Heavy Atoms 10
Rings 1
Aromatic Rings 0
Rotatable Bonds 1
Van der Waals Molecular Volume 163.92
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 3.31
Molar Refractivity 45.91

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Updated at
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