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etacrynic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM104962

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₁₃H₁₂Cl₂O₄

charge

mass

302.01126

reference

InChIKey

AVOLMBLBETYQHX-UHFFFAOYSA-N

InChI

InChI=1S/C13H12Cl2O4/c1-3-7(2)13(18)8-4-5-9(12(15)11(8)14)19-6-10(16)17/h4-5H,2-3,6H2,1H3,(H,16,17)

SMILES

C=C(CC)C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:4876 chebi:4876	etacrynic acid (2,3-Dichloro-4-(2-methylene-1-oxobutyl)phenoxy)acetic acid Crinuryl Edecril Edecrina Endecril Etacrinic acid Ethacrynate Hidromedin Hydromedin Methylenebutyrylphenoxyacetic acid Mingit Otacril Reomax Taladren Uregit [2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]acetic acid acide etacrynique acido etacrinico acidum etacrynicum ethacrynic acid
kegg.drug:D00313 keggD:D00313	Ethacrynic acid (USP) Etacrynic acid (JP18/INN)
hmdb:HMDB0015039	Ethacrynic acid (2,3-Dichloro-4-(2-methylene-1-oxobutyl)phenoxy)acetate (2,3-Dichloro-4-(2-methylene-1-oxobutyl)phenoxy)acetic acid 2-[2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]acetic acid Acid, etacrynic Acid, ethacrinic Acid, ethacrynic Acide etacrynique Acido etacrinico Acidum etacrynicum Crinuryl Edecril Edecrin Edecrina Endecril Etacrinate Etacrinic acid Etacrynate Etacrynic acid Etakrinic acid Ethacrinic acid Ethacryinic acid Ethacrynate Ethacrynate sodium Ethacrynic acid, sodium salt Hidromedin Hydromedin Methylenebutyrylphenoxyacetate Methylenebutyrylphenoxyacetic acid Mingit Otacril Reomax Sodium, ethacrynate Taladren Uregit ethacrynic acid
sabiork.compound:9103 sabiorkM:9103	Ethacrynic acid Etacrynic acid
metacyc.compound:ETHACRYNATE metacycM:ETHACRYNATE seed.compound:cpd27007 seedM:cpd27007	ethacrynate ethacrynic acid
hmdb:HMDB15039 keggD:M_D00313 seedM:M_cpd27007	secondary/obsolete/fantasy identifier