Structure Database (LMSD)

Common Name
Melissyl alcohol
Systematic Name
1-triacontanol
Synonyms
  • Myricyl alcohol
  • triacontan-1-ol
LM ID
LMFA05000006
Formula
C30H62O
Exact Mass
Calculate m/z
438.480065
Sum Composition
FOH 30:0
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

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

String Representations

InChiKey (Click to copy)
REZQBEBOWJAQKS-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C30H62O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31/h31H,2-30H2,1H3
SMILES (Click to copy)
C(CCCCCCCCCCCCCO)CCCCCCCCCCCCCCCC

Other Databases

Wikipedia
Melissyl alcohol
KEGG ID
C08392
CHEBI ID
28409
PubChem CID
68972
SwissLipids ID
SLM:000001246
Cayman ID
88840

Calculated Physicochemical Properties

Heavy Atoms 31
Rings 0
Aromatic Rings 0
Rotatable Bonds 28
Van der Waals Molecular Volume 536.35
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 11.21
Molar Refractivity 142.53

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Created at
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Updated at
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