(Q82915966)

English

2-Benzyl-5-(2,4-dimethoxyphenyl)-4-hydroxy-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)pentanimidic acid

chemical compound

In more languages

Statements

group of stereoisomers

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chemical compound

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475.23587315599997 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₉H₃₃NO₅

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based on heuristic

inferred from SMILES

canonical SMILES

COc1ccc(CC(O)CC(Cc2ccccc2)C(O)=NC2c3ccccc3CC2O)c(OC)c1

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

COc1ccc(C[C@@H](O)C[C@@H](Cc2ccccc2)C(=O)NC2c3ccccc3C[C@H]2O)c(OC)c1

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C29H33NO5/c1-34-24-13-12-21(27(18-24)35-2)15-23(31)16-22(14-19-8-4-3-5-9-19)29(33)30-28-25-11-7-6-10-20(25)17-26(28)32/h3-13,18,22-23,26,28,31-32H,14-17H2,1-2H3,(H,30,33)/t22-,23-,26-,28?/m1/s1

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FMBNUGXKRDKOQN-RXTRGRSESA-N

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CAS Registry Number

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26 December 2021

UniChem compound ID

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DSSTox substance ID

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DSSTOX compound identifier

DTXCID001367982

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