(Q82945756)

English

19-Methyl-10-oxostrychnidin-19-ium

group of stereoisomers with the chemical formula C₂₂H₂₅N₂O₂⁺

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

349.19105446009 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₂H₂₅N₂O₂⁺

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based on heuristic

inferred from SMILES

canonical SMILES

C[N+]12CCC34c5ccccc5N5C(=O)CC6OCC=C(C1)C(CC32)C6C54

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based on heuristic

inferred from isomeric SMILES

isomeric SMILES

C[N+]12CC[C@@]34c5ccccc5N5C(=O)C[C@@H]6OCC=C(C1)[C@H](C[C@@H]32)[C@@H]6[C@H]54

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C22H25N2O2/c1-24-8-7-22-15-4-2-3-5-16(15)23-19(25)11-17-20(21(22)23)14(10-18(22)24)13(12-24)6-9-26-17/h2-6,14,17-18,20-21H,7-12H2,1H3/q+1/t14-,17-,18-,20-,21-,22+,24?/m0/s1

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InChIKey

CTCZKABHVPGYMK-VXIAURRFSA-N

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1 reference

26 December 2021

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DSSTOX compound identifier

DTXCID101391578

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NSC number

99428

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(Q82945756)

19-Methyl-10-oxostrychnidin-19-ium

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Identifiers

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