Structure Database (LMSD)

Common Name
EHHDA
Systematic Name
11,12-epoxy-10-hydroxy-8E-heptadecenoic acid
Synonyms
LM ID
LMFA01070055
Formula
Exact Mass
Calculate m/z
298.214411
Sum Composition
Status
Curated

Classification

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Bos taurus (#9913)
Mammalia (#40674)
Conversion of 8,11,14-eicosatrienoic acid to 11,12-epoxy-10-hydroxy-8-heptadecenoic acid by aorta.,
Prostaglandins, 1983
Pubmed ID: 6856876

String Representations

InChiKey (Click to copy)
AIMIYBFEZJBNFT-PKNBQFBNSA-N
InChi (Click to copy)
InChI=1S/C17H30O4/c1-2-3-8-12-15-17(21-15)14(18)11-9-6-4-5-7-10-13-16(19)20/h9,11,14-15,17-18H,2-8,10,12-13H2,1H3,(H,19,20)/b11-9+
SMILES (Click to copy)
C(CCCCCC/C=C/C(O)C1OC1CCCCC)(=O)O

Other Databases

PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 1
Aromatic Rings
Rotatable Bonds 13
Van der Waals Molecular Volume 320.18
Topological Polar Surface Area 70.06
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
logP 4.54
Molar Refractivity 84.82

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Created at
19th Aug 2025
Updated at
19th Aug 2025