(Q82915964)

English

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

chemical compound

In more languages

Statements

group of stereoisomers

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chemical compound

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431.209658408 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₇H₂₉NO₄

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

OC(=NC1c2ccccc2CC1O)C(Cc1ccccc1)CC(O)Cc1ccccc1O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

O=C(NC1c2ccccc2C[C@H]1O)[C@H](Cc1ccccc1)C[C@H](O)Cc1ccccc1O

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C27H29NO4/c29-22(15-20-11-5-7-13-24(20)30)16-21(14-18-8-2-1-3-9-18)27(32)28-26-23-12-6-4-10-19(23)17-25(26)31/h1-13,21-22,25-26,29-31H,14-17H2,(H,28,32)/t21-,22-,25-,26?/m1/s1

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FYCAMGQPDONZNG-UJDCLUHESA-N

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CAS Registry Number

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1 reference

26 December 2021

UniChem compound ID

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DSSTox substance ID

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DSSTOX compound identifier

DTXCID601367980

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