Structure Database (LMSD)

Common Name
S-Rhynchophorol
Systematic Name
6-Methyl-2E-hepten-4S-ol
Synonyms
  • 4S-(E)-6-Methyl-2-hepten-4-ol
LM ID
LMFA05000481
Formula
C8H16O
Exact Mass
Calculate m/z
128.120115
Sum Composition
FOH 8:1
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty alcohols [FA05]

References

Comments
Pherobase Semiochemicals

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Rhynchophorus palmarum (#93128)
Insecta (#50557)
Chirality and field activity of rhynchophorol, the aggregation pheromone of the American palm weevil,
Naturwissenschaften, 1992

String Representations

InChiKey (Click to copy)
RQAFKZOPSRTJDU-WTSVBCDHSA-N
InChi (Click to copy)
InChI=1S/C8H16O/c1-4-5-8(9)6-7(2)3/h4-5,7-9H,6H2,1-3H3/b5-4+/t8-/m1/s1
SMILES (Click to copy)
C/C=C/[C@@H](O)CC(C)C

Other Databases

CHEBI ID
195857
PubChem CID
11105387

Calculated Physicochemical Properties

Heavy Atoms 9
Rings 0
Aromatic Rings 0
Rotatable Bonds 3
Van der Waals Molecular Volume 153.11
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 2.26
Molar Refractivity 40.79

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Updated at
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