5,6-Dimethoxy-1H-azuleno[1,2,3-ij]isoquinoline-9,10-dione (Q82910525)

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chemical compound

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Language	Label	Description	Also known as
English	5,6-Dimethoxy-1H-azuleno[1,2,3-ij]isoquinoline-9,10-dione	chemical compound

Statements

instance of

type of chemical entity

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subclass of

alkaloid

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mass

307.084457896 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₈H₁₃NO₄

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canonical SMILES

O=C1C=CC=2C(=CC1=O)C=3NC=CC4=CC(OC)=C(OC)C2C43

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found in taxon

Cissampelos pareira

2 references

stated in

Structures and solid state tautomeric forms of two novel antileukemic tropoloisoquinoline alkaloids, pareirubrines A and B, from Cissampelos pareira

stated in

Structures and solid state tautomeric forms of two novel antileukemic tropoloisoquinoline alkaloids, pareirubrines A and B, from Cissampelos pareira

Identifiers

InChI

InChI=1S/C18H13NO4/c1-22-14-7-9-5-6-19-17-11-8-13(21)12(20)4-3-10(11)16(15(9)17)18(14)23-2/h3-8,19H,1-2H3

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InChIKey

KSGDMYJIAGEDPQ-UHFFFAOYSA-N

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CAS Registry Number

152845-78-8

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PubChem CID

5488901

1 reference

stated in

PubChem

retrieved

17 September 2022

based on heuristic

inferred from InChIKey

DSSTox substance ID

DTXSID80934617

1 reference

matched by identifier from

InChIKey

InChIKey

KSGDMYJIAGEDPQ-UHFFFAOYSA-N

DSSTOX compound identifier

DTXCID701363262

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