Axinelline A

cas: 1593741-99-1 — see every product listed under this CAS number, including other names

Axinelline A (CAS 1593741-99-1) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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Structural formula: {0} (CAS {1})

Axinelline A is a N-acylglycine.

Source: ChEBI

Identity
Molecular formulaC12H15NO6
Molecular weight269.25 g/mol
IUPAC nameethyl (2S)-2-[(2,3-dihydroxybenzoyl)amino]-3-hydroxypropanoate
InChIKeyZNAULGVROLOSBS-QMMMGPOBSA-N
SMILESCCOC(=O)[C@H](CO)NC(=O)C1=C(C(=CC=C1)O)O

Computed by PubChem (NCBI)

Synonyms: Axinelline A, ethyl (2S)-2-[(2,3-dihydroxybenzoyl)amino]-3-hydroxypropanoate, ethyl (2S)-2-((2,3-dihydroxybenzoyl)amino)-3-hydroxypropanoate, 4-methoxy-4,5,6,7-tetrahydro-1H-pyrrolo(2,3-c)azepin-8-one, orb1981815
Isomers (same molecular formula)
1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethanamine;oxalic acid C12H15NO6
3,5-bis(methoxycarbonyl)-2,6-dimethyl-1,4-dihydropyridine-4-carboxylic acid C12H15NO6
2-[(3,4,5-trimethoxybenzoyl)amino]acetic acid C12H15NO6
diethyl 3,6-dihydro-2H-[1,4]dioxino[2,3-c]pyrrole-5,7-dicarboxylate C12H15NO6
4-[[4,5-bis(hydroxymethyl)-2-methyl-3-pyridinyl]oxy]-4-oxobutanoic acid C12H15NO6
4-[[5-hydroxy-4-(hydroxymethyl)-6-methyl-3-pyridinyl]methoxy]-4-oxobutanoic acid C12H15NO6
methyl 4,5-diethoxy-2-nitrobenzoate C12H15NO6
14-nitro-2,5,8,11-tetraoxabicyclo[10.4.0]hexadeca-1(12),13,15-triene C12H15NO6
1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamine;oxalic acid C12H15NO6
(2,5-dioxopyrrolidin-1-yl) 3-(2-prop-2-ynoxyethoxy)propanoate C12H15NO6
methyl 5-acetyloxy-4-(2-methoxy-2-oxoethyl)-2-methyl-1H-pyrrole-3-carboxylate C12H15NO6
methyl 2-methoxy-5-nitro-4-propan-2-yloxybenzoate C12H15NO6

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