(Q72437250)

English

Allyl-beta-galactopyranoside

group of stereoisomers with the chemical formula C₉H₁₆O₆

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Statements

group of stereoisomers

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chemical compound

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220.094688232 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₉H₁₆O₆

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canonical SMILES

C=CCOC1OC(CO)C(O)C(O)C1O

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C=CCOC1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O

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based on heuristic

inferred from InChI

Identifiers

InChI=1S/C9H16O6/c1-2-3-14-9-8(13)7(12)6(11)5(4-10)15-9/h2,5-13H,1,3-4H2/t5-,6+,7+,8-,9?/m1/s1

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XJNKZTHFPGIJNS-MBOVONDJSA-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

DTXCID701377077

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