(Q82157447)

English

ST50405945

group of stereoisomers with the chemical formula C₂₈H₃₂O₅

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Statements

group of stereoisomers

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chemical compound

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448.22497412399997 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₂O₅

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based on heuristic

inferred from SMILES

canonical SMILES

COC1OC(C)C(OCc2ccccc2)C(OCc2ccccc2)C1OCc1ccccc1

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

COC1O[C@@H](C)[C@@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C28H32O5/c1-21-25(30-18-22-12-6-3-7-13-22)26(31-19-23-14-8-4-9-15-23)27(28(29-2)33-21)32-20-24-16-10-5-11-17-24/h3-17,21,25-28H,18-20H2,1-2H3/t21-,25+,26+,27-,28?/m0/s1

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QTDLREJYMFIJBR-KURBPKLJSA-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

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