(Q82187451)

English

NSC127917

chemical compound

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Statements

type of chemical entity

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chemical compound

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299.2885 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₃H₁₃N₇O₂

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canonical SMILES

C1=CC(=CC=C1C(=O)O)NCC2=NC3=NC(=NC(=C3N2)N)N

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Identifiers

InChI=1S/C13H13N7O2/c14-10-9-11(20-13(15)19-10)18-8(17-9)5-16-7-3-1-6(2-4-7)12(21)22/h1-4,16H,5H2,(H,21,22)(H5,14,15,17,18,19,20)

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WEAIDDOLGAIXED-UHFFFAOYSA-N

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CAS Registry Number

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UniChem compound ID

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DSSTox substance ID

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DSSTOX compound identifier

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Sitelinks

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