Structure Database (LMSD)

Common Name
14,15-HxB3 (13R)
Systematic Name
13R-hydroxy-14S,15S-epoxy-5Z,8Z,11Z-eicosatrienoic acid
Synonyms
  • 14,15-Hepoxilin B3 (13R)
LM ID
LMFA03090006
Status
Active
Exact Mass
Calculate m/z
336.23006
Formula
Abbrev


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MDLMOL SDF CSV TSV
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Main

Classification

String Representations

InChiKey (Click to copy)
FMRVHRPEVIVXKX-ZJIVTKJASA-N
InChi (Click to copy)
InChI=1S/C20H32O4/c1-2-3-11-15-18-20(24-18)17(21)14-12-9-7-5-4-6-8-10-13-16-19(22)23/h5-8,12,14,17-18,20-21H,2-4,9-11,13,15-16H2,1H3,(H,22,23)/b7-5-,8-6-,14-12-/t17-,18+,20+/m1/s1
SMILES (Click to copy)

References

Reference
Biosynthesis of 14,15-Hepoxilins in Human L1236 Hodgkin Lymphoma Cells and Eosinophils
?sa Brunnstrom, Mats Hamberg, William J. Griffiths, Bengt Mannervik and Hans-Erik Claesson
Lipids Volume 46, Number 1, 69-79

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Homo sapiens (#9606)
Mammalia (#40674)
Biosynthesis of 14,15-hepoxilins in human l1236 Hodgkin lymphoma cells and eosinophils.,
Lipids, 2011
Pubmed ID: 21046276

Other Databases

CHEBI ID
PubChem CID
SwissLipids ID

Calculated Physicochemical Properties

Heavy Atoms 24
Rings 1
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 366.80
Topological Polar Surface Area 70.06
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
logP 5.26
Molar Refractivity 98.49

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Updated at
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