Structure Database (LMSD)

Common Name
30:2(9Z,23Z)
Systematic Name
9Z,23Z-triacontadienoic acid
Synonyms
  • C30:2n-7,21
LM ID
LMFA01030879
Formula
C30H56O2
Exact Mass
Calculate m/z
448.42803
Sum Composition
FA 30:2
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty Acids and Conjugates [FA01]
Unsaturated fatty acids [FA0103]

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

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Trikentrion (#484443)
Demospongiae (#6042)
Non-methylene-interrupted fatty acids from marine invertebrates: Occurrence, characterization and biological properties.,
Biochimie, 2009
Pubmed ID: 19376188

String Representations

InChiKey (Click to copy)
HTSGLDYRQRJCAM-KEBMZOIYSA-N
InChi (Click to copy)
InChI=1S/C30H56O2/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/h7-8,21-22H,2-6,9-20,23-29H2,1H3,(H,31,32)/b8-7-,22-21-
SMILES (Click to copy)
C(CCCCCCC/C=C\CCCCCCCCCCCC/C=C\CCCCCC)(=O)O

Other Databases

PubChem CID
21774062

Calculated Physicochemical Properties

Heavy Atoms 32
Rings 0
Aromatic Rings 0
Rotatable Bonds 26
Van der Waals Molecular Volume 537.22
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 10.57
Molar Refractivity 142.40

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Created at
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Updated at
25th Apr 2022