CHEBI:140402 - tert-butyl ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name tert-butyl ester
ChEBI ID CHEBI:140402
ChEBI ASCII Name tert-butyl ester
Definition A carboxylic ester resulting from the formal condensation of a carboxylic acid with tert-butanol.
Stars This entity has been manually annotated by the ChEBI Team.
Download Molfile XML SDF
Formula C5H9O2R
Net Charge 0
Average Mass (excl. R groups) 101.124
Monoisotopic Mass (excl. R groups) 101.06025
SMILES C(OC(C)(C)C)(*)=O
ChEBI Ontology
Outgoing tert-butyl ester (CHEBI:140402) has functional parent tert-butanol (CHEBI:45895)
tert-butyl ester (CHEBI:140402) is a carboxylic ester (CHEBI:33308)
Incoming (2S)-2-[[[4-[(4-chloroanilino)-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid tert-butyl ester (CHEBI:109238) is a tert-butyl ester (CHEBI:140402)
(2S)-2-[[[4-[[4-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]anilino]-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]propanoic acid tert-butyl ester (CHEBI:107599) is a tert-butyl ester (CHEBI:140402)
(2S)-2-[[[4-[[[(2S)-1-[(2-methylpropan-2-yl)oxy]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]-3-phenylpropanoic acid tert-butyl ester (CHEBI:121898) is a tert-butyl ester (CHEBI:140402)
(2S)-2-[[[5-[[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentylamino]-oxomethyl]-1H-imidazol-4-yl]-oxomethyl]amino]propanoic acid tert-butyl ester (CHEBI:107042) is a tert-butyl ester (CHEBI:140402)
(2S)-2-[[[5-[[methyl-(phenylmethyl)amino]-oxomethyl]-1H-imidazol-4-yl]-oxomethyl]amino]-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid tert-butyl ester (CHEBI:116491) is a tert-butyl ester (CHEBI:140402)
(2S)-2-[[oxo-[5-[oxo-(4-phenyl-1-piperazinyl)methyl]-1H-imidazol-4-yl]methyl]amino]-3-phenylpropanoic acid tert-butyl ester (CHEBI:113015) is a tert-butyl ester (CHEBI:140402)
(2S)-4-methyl-2-[[[5-(methylcarbamoyl)-1H-imidazol-4-yl]-oxomethyl]amino]pentanoic acid tert-butyl ester (CHEBI:114708) is a tert-butyl ester (CHEBI:140402)
(2S)-4-methyl-2-[[[5-[[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentylamino]-oxomethyl]-1H-imidazol-4-yl]-oxomethyl]amino]pentanoic acid tert-butyl ester (CHEBI:109309) is a tert-butyl ester (CHEBI:140402)
(2S)-4-methyl-2-[[oxo-[5-[oxo-[(phenylmethyl)amino]methyl]-1H-imidazol-4-yl]methyl]amino]pentanoic acid tert-butyl ester (CHEBI:109288) is a tert-butyl ester (CHEBI:140402)
2,6-dimethyl-4-[2-[3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester (CHEBI:94480) is a tert-butyl ester (CHEBI:140402)
2,6-dimethyl-4-[2-[3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]phenyl]-3,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester (CHEBI:94394) is a tert-butyl ester (CHEBI:140402)
2-[[2-[[2-(3,5-difluorophenyl)-1-oxoethyl]amino]-1-oxopropyl]amino]-2-phenylacetic acid tert-butyl ester (CHEBI:91825) is a tert-butyl ester (CHEBI:140402)
2-[[5-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]-4-oxo-2-phenyl-1-benzopyran-7-yl]oxy]acetic acid tert-butyl ester (CHEBI:114535) is a tert-butyl ester (CHEBI:140402)
2-[[[4-[(4-chloroanilino)-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]acetic acid tert-butyl ester (CHEBI:117065) is a tert-butyl ester (CHEBI:140402)
2-[[[4-[[(diphenylmethyl)amino]-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]acetic acid tert-butyl ester (CHEBI:112998) is a tert-butyl ester (CHEBI:140402)
2-[[[4-[[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentylamino]-oxomethyl]-1H-imidazol-5-yl]-oxomethyl]amino]acetic acid tert-butyl ester (CHEBI:115018) is a tert-butyl ester (CHEBI:140402)
3-[(3aS,10bS)-2-[4-(3-hydroxypropoxy)phenyl]-4-oxo-5-prop-2-enyl-6,10b-dihydrooxazolo[4,5-d][2]benzazepin-3a-yl]propanoic acid tert-butyl ester (CHEBI:125223) is a tert-butyl ester (CHEBI:140402)
3-[(4R,5R)-4-carbamoyl-2-[4-(3-hydroxypropoxy)phenyl]-5-phenyl-5H-oxazol-4-yl]propanoic acid tert-butyl ester (CHEBI:125224) is a tert-butyl ester (CHEBI:140402)
3-[(4S,5S)-2-[4-(3-hydroxypropoxy)phenyl]-4-[oxo(1-piperidinyl)methyl]-5-phenyl-5H-oxazol-4-yl]propanoic acid tert-butyl ester (CHEBI:125219) is a tert-butyl ester (CHEBI:140402)
4-[[[5-[[[(2S)-1-[(2-methylpropan-2-yl)oxy]-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxohexan-2-yl]amino]-oxomethyl]-1H-imidazol-4-yl]-oxomethyl]amino]benzoic acid ethyl ester (CHEBI:121628) is a tert-butyl ester (CHEBI:140402)
N-(tert-butoxycarbonyl)-L-seryl-L-valyl-N-{(2S,3E)-5-ethoxy-5-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]pent-3-en-2-yl}-L-leucinamide (CHEBI:149679) is a tert-butyl ester (CHEBI:140402)
tert-butyl 4-hydroxy-3-methoxybenzoate (CHEBI:142523) is a tert-butyl ester (CHEBI:140402)
tert-butyl N-{1-[(1S)-1-{[(1R,2S)-1-(benzylcarbamoyl)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl]carbamoyl}-2-cyclopropylethyl]-2-oxopyridin-3-yl}carbamate (CHEBI:147409) is a tert-butyl ester (CHEBI:140402)
tert-butyl benzoate (CHEBI:34034) is a tert-butyl ester (CHEBI:140402)
DAPT (CHEBI:86193) is a tert-butyl ester (CHEBI:140402)
fenpyroximate (CHEBI:5011) is a tert-butyl ester (CHEBI:140402)
JQ1 (CHEBI:137113) is a tert-butyl ester (CHEBI:140402)
lacidipine (CHEBI:135737) is a tert-butyl ester (CHEBI:140402)
LSM-6260 (CHEBI:95026) is a tert-butyl ester (CHEBI:140402)
LSM-6333 (CHEBI:95081) is a tert-butyl ester (CHEBI:140402)
LSM-6732 (CHEBI:95356) is a tert-butyl ester (CHEBI:140402)
Ro 19-4603 (CHEBI:34952) is a tert-butyl ester (CHEBI:140402)
SID 26681509 (CHEBI:167893) is a tert-butyl ester (CHEBI:140402)
SRS16-86 (CHEBI:173096) is a tert-butyl ester (CHEBI:140402)
t-butyl hexadecanoate (CHEBI:131410) is a tert-butyl ester (CHEBI:140402)
XJB-5-131 (CHEBI:173099) is a tert-butyl ester (CHEBI:140402)
Synonyms Sources
1,1-dimethylethyl ester ChEBI
1,1-dimethylethyl esters ChEBI
t-butyl ester ChEBI
t-butyl esters ChEBI
tert-butyl esters ChEBI
Last Modified
27 May 2021