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
Formula
C20H34O
Exact Mass
Calculate m/z
290.260965
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Level 4 Class
Prenol Lipids [PR]
Isoprenoids [PR01]
C20 isoprenoids (diterpenes) [PR0104]
Acyclic diterpenoids [PR010401]

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

Other Databases

CHEBI ID
18822
PubChem CID
13292465

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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