2-[2-(1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)ETHYL]-4-(4'-ETHOXY-1,1'-BIPHENYL-4-YL)-4-OXOBUTANOIC ACID (CHEBI:41828)

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CHEBI:41828 - 2-[2-(1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)ETHYL]-4-(4'-ETHOXY-1,1'-BIPHENYL-4-YL)-4-OXOBUTANOIC ACID

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ChEBI ID	CHEBI:41828
ChEBI Name	2-[2-(1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)ETHYL]-4-(4'-ETHOXY-1,1'-BIPHENYL-4-YL)-4-OXOBUTANOIC ACID
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Last Modified	16 May 2008
Downloads	Molfile

Formula	C28H25NO6
Net Charge	0
Average Mass	471.509
Monoisotopic Mass	471.16819
SMILES	[H]OC(=O)[C@]([H])(C([H])([H])C(=O)c1c([H])c([H])c(-c2c([H])c([H])c(OC([H])([H])C([H])([H])[H])c([H])c2[H])c([H])c1[H])C([H])([H])C([H])([H])N1C(=O)c2c([H])c([H])c([H])c([H])c2C1=O
InChI	InChI=1S/C28H25NO6/c1-2-35-22-13-11-19(12-14-22)18-7-9-20(10-8-18)25(30)17-21(28(33)34)15-16-29-26(31)23-5-3-4-6-24(23)27(29)32/h3-14,21H,2,15-17H2,1H3,(H,33,34)/t21-/m0/s1
InChIKey	AQYSXARQCHHHLK-NRFANRHFSA-N

ChEBI Ontology

Outgoing Relation(s)
	2-[2-(1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)ETHYL]-4-(4'-ETHOXY-1,1'-BIPHENYL-4-YL)-4-OXOBUTANOIC ACID (CHEBI:41828) is a unclassifieds (CHEBI:27189)

Synonyms	Source
2-[2-(1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL)ETHYL]-4-(4'-ETHOXY-1,1'-BIPHENYL-4-YL)-4-OXOBUTANOIC ACID	PDBeChem
(2S)-2-[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl]-4-(4'-ethoxybiphenyl-4-yl)-4-oxobutanoic acid	PDBeChem

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