Fecapentaene-14

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Basic information

CAS: 91379-15-6
Standard SMILES: CCCC/C=C/C=C/C=C/C=C/C=C/OC[C@@H](O)CO
InChIKey: UCSSTHOWGCFAPL-XQICVRGGSA-N
Molecular formula: C17H26O3
Average molar mass: 278.4 g/mol
Monoisotopic mass: 278.18819469

Overview

fecapentaene-14 has been reported in Homo sapiens with data available.

Names & identifiers

Preferred name: Fecapentaene-14
IUPAC: (2S)-3-[(1E,3E,5E,7E,9E)-tetradeca-1,3,5,7,9-pentaenoxy]propane-1,2-diol

Names & synonyms

Fecapentaene-14Fecapentaene 1491379-15-6CCRIS 1650UNII-DU0IZ4P16ODU0IZ4P16O(2S)-3-[(1E,3E,5E,7E,9E)-tetradeca-1,3,5,7,9-pentaenoxy]propane-1,2-diol(all-E)-3-(1,3,5,7,9-Tetradecapentaenyloxy)-1,2-propanediol1,2-Propanediol, 3-(1,3,5,7,9-tetradecapentaenyloxy)-, (all-E)-3-(1,3,5,7,9-Tetradecapentaenyloxy)-1,2-propanediol, (S-(all-E))-1,2-Propanediol, 3-((1E,3E,5E,7E,9E)-1,3,5,7,9-tetradecapentaenyloxy)-, (2S)-1-O-(1E,3E,5E,7E,9E-tetradecapentenyl)-sn-glycerol

Show more names

1,2-PROPANEDIOL, 3-(1,3,5,7,9-TETRADECAPENTAENYLOXY)-, (S-(ALL-E))-(2S)-3-((1E,3E,5E,7E,9E)-tetradeca-1,3,5,7,9-pentaenoxy)propane-1,2-diolRefChem:140062LMGL01020071MG O-14:5Q27276599

Database identifiers

CAS: 91379-15-6
PubChem CID: 6437375
UNII: DU0IZ4P16O
Nikkaji: J371.933B

Properties

Computed structural properties

XLogP: 3.8
Topological polar surface area: 49.7 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 11
Heavy atoms: 20
Formal charge: 0
Complexity: 338

Experimental & physicochemical properties

Lipids · 2 items

Lipids -> Glycerolipids [GL] -> Monoradylglycerols [GL01] -> Monoalkylglycerols [GL0102]

Lipids -> Glycerolipids [GL] -> Monoradylglycerols [GL01]

Related reactions

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Compound notes

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