CHEBI:107633 - 3,4,5-trimethoxybenzoic acid 8-(diethylamino)octyl ester

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ChEBI Name 3,4,5-trimethoxybenzoic acid 8-(diethylamino)octyl ester
ChEBI ID CHEBI:107633
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H37NO5
Net Charge 0
Average Mass 395.534
Monoisotopic Mass 395.26717
InChI InChI=1S/C22H37NO5/c1-6-23(7-2)14-12-10-8-9-11-13-15-28-22(24)18-16-19(25-3)21(27-5)20(17-18)26-4/h16-17H,6-15H2,1-5H3
InChIKey IBQMHBGFMLHHLE-UHFFFAOYSA-N
SMILES CCN(CC)CCCCCCCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 3,4,5-trimethoxybenzoic acid 8-(diethylamino)octyl ester (CHEBI:107633) is a trihydroxybenzoic acid (CHEBI:27115)
Manual Xref Database
LSM-18991 LINCS
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