(Q82949132)

English

17-[(Furan-3-yl)methyl]-4,5-epoxymorphinan-3-ol--hydrogen chloride (1/1)

group of stereoisomers with the chemical formula C₂₁H₂₄ClNO₃

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Statements

group of stereoisomers

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chemical compound

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373.14447130799994 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₄ClNO₃

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based on heuristic

inferred from SMILES

canonical SMILES

Cl.Oc1ccc2c3c1OC1CCCC4C(C2)N(Cc2ccoc2)CCC314

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

Cl.Oc1ccc2c3c1OC1CCCC4[C@H](C2)N(Cc2ccoc2)CC[C@@]314

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based on heuristic

inferred from InChI

Identifiers

InChI=1S/C21H23NO3.ClH/c23-17-5-4-14-10-16-15-2-1-3-18-21(15,19(14)20(17)25-18)7-8-22(16)11-13-6-9-24-12-13;/h4-6,9,12,15-16,18,23H,1-3,7-8,10-11H2;1H/t15?,16-,18?,21-;/m0./s1

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JHKZXEIMWFQKAF-HVEPPIBQSA-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

DTXCID301394342

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