1-(1-glycero)Dodeca-1,3,5,7,9-pentaene
3-[(1E,3E,5E,7E,9E)-dodeca-1,3,5,7,9-pentaenoxy]propane-1,2-diol
Molecular Identity
1-(1-glycero)Dodeca-1,3,5,7,9-pentaene
3-[(1E,3E,5E,7E,9E)-dodeca-1,3,5,7,9-pentaenoxy]propane-1,2-diol
PubChem CID: 6437069
2D Structure
Properties
C15H22O3
Molecular Formula
250.33
Molecular Weight
g/mol
250.1569
Exact Mass
Da
2.8
XLogP
Drug-like (Lipinski: < 5)
49.7
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
3
H-Bond Acceptors
312
Complexity
SMILES
Canonical SMILES
SMILES: CCC=CC=CC=CC=CC=COCC(CO)OIsomeric SMILES
SMILES: CC/C=C/C=C/C=C/C=C/C=C/OCC(CO)OSynonyms(8)
GDPE1-(1-glycero)Dodeca-1,3,5,7,9-pentaene84000-59-91,2-Propanediol, 3-(1,3,5,7,9-dodecapentaenyloxy)-RefChem:739083-[(1E,3E,5E,7E,9E)-dodeca-1,3,5,7,9-pentaenoxy]propane-1,2-diolCHEMBL486102SCHEMBL29392448
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to 1-(1-glycero)Dodeca-1,3,5,7,9-pentaene
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