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CHEBI:151072 - Benzoic acid, 4-amino-, 4-acetoxy-2,2,6,6-tetramethyl-1-piperidinyl ester

ChEBI IDCHEBI:151072
ChEBI NameBenzoic acid, 4-amino-, 4-acetoxy-2,2,6,6-tetramethyl-1-piperidinyl ester
Stars
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DownloadsMolfile
FormulaC18H26N2O4
Net Charge0
Average Mass334.416
Monoisotopic Mass334.18926
SMILESCC(=O)OC1CC(C)(C)N(OC(=O)c2ccc(N)cc2)C(C)(C)C1
InChIInChI=1S/C18H26N2O4/c1-12(21)23-15-10-17(2,3)20(18(4,5)11-15)24-16(22)13-6-8-14(19)9-7-13/h6-9,15H,10-11,19H2,1-5H3
InChIKeyBVCXOEIOBRWZCA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) cell lysate (BTO:0004304) MetaboLights (MTBLS1079) Strain: Escherichia coli str. K-12 substr. DH10B [NCBITAXON:316385]
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Benzoic acid, 4-amino-, 4-acetoxy-2,2,6,6-tetramethyl-1-piperidinyl ester (CHEBI:151072) is a aminobenzoic acid (CHEBI:22495)
IUPAC Name 
(4-acetyloxy-2,2,6,6-tetramethylpiperidin-1-yl) 4-aminobenzoate