Structure Database (LMSD)

Common Name
Ceroplastic acid
Systematic Name
pentatriacontanoic acid
Synonyms
  • C35:0
LM ID
LMFA01010035
Formula
C35H70O2
Exact Mass
Calculate m/z
522.53758
Sum Composition
FA 35:0
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty Acids and Conjugates [FA01]
Straight chain fatty acids [FA0101]

Reactions

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ⓘ Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
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Reactions graph legend

String Representations

InChiKey (Click to copy)
HVUCKZJUWZBJDP-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C35H70O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35(36)37/h2-34H2,1H3,(H,36,37)
SMILES (Click to copy)
C(CCCCCCCCCCCCCCCCCCC(O)=O)CCCCCCCCCCCCCCC

Other Databases

Wikipedia
Ceroplastic_acid
CHEBI ID
165440
LIPIDBANK ID
DFA0035
PubChem CID
5282595
PlantFA ID
10180

Calculated Physicochemical Properties

Heavy Atoms 37
Rings 0
Aromatic Rings 0
Rotatable Bonds 33
Van der Waals Molecular Volume 629.00
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 12.96
Molar Refractivity 165.67

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Created at
-
Updated at
25th Apr 2022