(E,E,E)-7-hydroxymethyl-3,11,15-trimethyl-2,6,10,14-hexadecatetraen-1-ol diisonicotinate

HCID 86736498
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Basic information

Standard SMILES
CC(C)=CCC/C(C)=C/CC/C(=C\CC/C(C)=C/CO)CO.O=C(O)c1ccncc1.O=C(O)c1ccncc1
InChIKey
NHCQEDWBTUUQBE-KNHOCDLTSA-N
Molecular formula
C32H44N2O6
Average molar mass
552.7 g/mol

Names & identifiers

Preferred name
(E,E,E)-7-hydroxymethyl-3,11,15-trimethyl-2,6,10,14-hexadecatetraen-1-ol diisonicotinate
IUPAC
(2E,6E)-2-[(3E)-4,8-dimethylnona-3,7-dienyl]-6-methylocta-2,6-diene-1,8-diol;bis(pyridine-4-carboxylic acid)

Names & synonyms

NHCQEDWBTUUQBE-KNHOCDLTSA-N(E,E,E)-7-hydroxymethyl-3,11,15-trimethyl-2,6,10,14-hexadecatetraen-1-ol diisonicotinate

Database identifiers

PubChem CID
86736498

Properties

Computed structural properties

Topological polar surface area
141 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
8
Rotatable bonds
13
Heavy atoms
40

Related reactions

2 records
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Linked notes

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