Structure Database (LMSD)

Common Name
(Z,Z,Z)-geranylgeraniol
Systematic Name
(2Z,6Z,10Z)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-ol
Synonyms
  • nerylnerol
LM ID
LMPR0104010018
Status
Active
Exact Mass
Calculate m/z
290.260965
Formula


Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
OJISWRZIEWCUBN-XBQSVVNOSA-N
InChi (Click to copy)
InChI=1S/C20H34O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h9,11,13,15,21H,6-8,10,12,14,16H2,1-5H3/b18-11-,19-13-,20-15-
SMILES (Click to copy)
C(=C(/C)\C)\CC/C(=C\CC/C(/C)=C\CC/C(=C\CO)/C)/C

References

Other Databases

CHEBI ID
PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 0
Aromatic Rings 0
Rotatable Bonds 10
Van der Waals Molecular Volume 352.79
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 6.41
Molar Refractivity 95.98

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Created at
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Updated at
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