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acetylsalicylate

Properties

Image

Occurences in reactions

MNX_ID

MNXM3526

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	0

formula

C₉H₇O₄

charge

-1

mass

179.03498

reference

chebi:13719

InChIKey

BSYNRYMUTXBXSQ-UHFFFAOYSA-M

InChI

InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)/p-1

SMILES

CC(=O)Oc1ccccc1C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-2314693 reactomeM:R-ALL-2314693 CHEBI:13719 chebi:13719	acetylsalicylate 2-(acetyloxy)benzoate
kegg.drug:D00109 keggD:D00109	Aspirin (JP18/USP) Acetylsalicylic acid Aspalon (JAN) Durlaza (TN) Easprin (TN)
hmdb:HMDB0001879	Aspirin 2-(ACETYLOXY)benzoIC ACID 2-(ACETYLOXY)benzoate 2-(acetyloxy)benzoic acid 2-Acetoxybenzenecarboxylate 2-Acetoxybenzenecarboxylic acid 2-Acetoxybenzoate 2-Acetoxybenzoic acid 2-Carboxyphenyl acetate ASA Acenterine Acetard Aceticyl Acetol Acetonyl Acetophen Acetosal Acetosalin Acetylin Acetylsalicylate Acetylsalicylic acid Acetylsalicylsaeure Acetyonyl Acetysal Acetysalicylic acid Acid, acetylsalicylic Acide 2-(acetyloxy)benzoique Acide acetylsalicylique Acido acetilsalicilico Acidum acetylsalicylicum Acylpyrin Aloxiprimum Asatard Aspalon Aspergum Aspirdrops Azetylsalizylsaeure Benaspir Bialpirinia Bufferin Caprin Cardioaspirina Colfarit Dispril Durlaza Easprin Ecolen Ecotrin Empirin Endosprin Endydol Magnecyl Micristin O-(Acetyloxy)benzoate O-(Acetyloxy)benzoic acid O-Acetoxybenzoate O-Acetoxybenzoic acid O-Acetylsalicylate O-Acetylsalicylic acid O-Carboxyphenyl acetate O-Carboxyphenyl acetic acid Persistin Pharmacin Polopirin Polopiryna Premaspin Rheumintabletten Rhodine Salcetogen Saletin Salicylate acetate Salicylic acid acetate Salicylic acid acetic acid Salospir Solprin Solprin acid Solpyron Solupsan Tasprin Temperal Toldex Triaminicin Zorprin aspirin
seed.compound:cpd01006 seedM:cpd01006	Aspirin 2-Acetoxybenzenecarboxylic acid 2-acetoxybenzenecarboxylic acid Acetylsalicylate Acetylsalicylic acid CPDIM-6114 acetylsalicylate acetylsalicylic acid aspirin
kegg.compound:C01405 keggC:C01405	Aspirin 2-Acetoxybenzenecarboxylic acid Acetylsalicylate Acetylsalicylic acid
CHEBI:15365 chebi:15365	acetylsalicylic acid 2-(ACETYLOXY)BENZOIC ACID 2-(acetyloxy)benzoic acid 2-Acetoxybenzenecarboxylic acid 2-acetoxybenzoic acid ASA Acetylsalicylate Acetylsalicylic acid Acetylsalicylsaeure Aspirin Azetylsalizylsaeure Easprin O-acetylsalicylic acid acide 2-(acetyloxy)benzoique acide acetylsalicylique acido acetilsalicilico acidum acetylsalicylicum o-acetoxybenzoic acid o-carboxyphenyl acetate salicylic acid acetate
metacyc.compound:CPD-524 metacycM:CPD-524	aspirin 2-acetoxybenzenecarboxylic acid acetylsalicylate acetylsalicylic acid
envipath:...0abb6fc924de envipathM:...0abb6fc924de	compound 0052294
hmdb:HMDB01879 chebi:22188 chebi:22203 chebi:2890 chebi:40705 chebi:71414 keggC:M_C01405 keggD:M_D00109 seedM:M_cpd01006	secondary/obsolete/fantasy identifier