Methyl 2-(docosa-4,7,10,13,16,19-hexaenoylamino)propanoate

HCID 85041004
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Basic information

Standard SMILES
CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)NC(C)C(=O)OC
InChIKey
XFJWIUVBXQUUNW-UHFFFAOYSA-N
Molecular formula
C26H39NO3
Average molar mass
413.6 g/mol
Monoisotopic mass
413.29299411

Names & identifiers

Preferred name
Methyl 2-(docosa-4,7,10,13,16,19-hexaenoylamino)propanoate
IUPAC
methyl 2-(docosa-4,7,10,13,16,19-hexaenoylamino)propanoate

Names & synonyms

SCHEMBL2406545

Database identifiers

PubChem CID
85041004

Properties

Computed structural properties

XLogP
5.8
Topological polar surface area
55.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
17
Heavy atoms
30

Related reactions

2 records
New reaction record

Compound notes

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