(Q82901761)

English

4,5,6-Tris(benzyloxy)cyclohexane-1,2,3-triol

group of stereoisomers with the chemical formula C₂₇H₃₀O₆

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Statements

group of stereoisomers

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chemical compound

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450.20423867999995 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₇H₃₀O₆

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based on heuristic

inferred from SMILES

canonical SMILES

OC1C(O)C(OCc2ccccc2)C(OCc2ccccc2)C(OCc2ccccc2)C1O

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

OC1[C@@H](O)[C@H](OCc2ccccc2)C(OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1O

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C27H30O6/c28-22-23(29)25(31-16-19-10-4-1-5-11-19)27(33-18-21-14-8-3-9-15-21)26(24(22)30)32-17-20-12-6-2-7-13-20/h1-15,22-30H,16-18H2/t22?,23-,24-,25-,26+,27?/m1/s1

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DLTULJLWMBPREM-UZXVYOLYSA-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

DTXCID701355936

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