(Q4545666)

English

1,3,8-trihydroxyanthraquinone

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

biogenic anthraquinones

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trihydroxyanthraquinone

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image of molecular model or crystal lattice model

1,3,8-trihydroxyanthraquinone-3D-balls.png
1,515 × 1,056; 233 KB

depicts

ball-and-stick model

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mass

256.037173356 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₄H₈O₅

1 reference

imported from Wikimedia project

English Wikipedia

canonical SMILES

O=C1C2=C(C=C(O)C=C2O)C(C3=CC=CC(O)=C31)=O

1 reference

imported from Wikimedia project

1 reference

A type II polyketide synthase is responsible for anthraquinone biosynthesis in Photorhabdus luminescens

Identifiers

InChI

InChI=1S/C14H8O5/c15-6-4-8-12(10(17)5-6)14(19)11-7(13(8)18)2-1-3-9(11)16/h1-5,15-17H

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InChIKey

VVEKCQAFOLKNKB-UHFFFAOYSA-N

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CAS Registry Number

52431-74-0

2 references

imported from Wikimedia project

English Wikipedia

InChIKey

VVEKCQAFOLKNKB-UHFFFAOYSA-N

8 April 2021

https://commonchemistry.cas.org/detail?cas_rn=52431-74-0

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1 reference

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Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

DTXCID20448985

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Natural Product Atlas ID

NPA020274

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based on heuristic

inferred from InChIKey

Freebase ID

/m/0b6f_zb

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Microsoft Academic ID

2780646864

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(Q4545666)

1,3,8-trihydroxyanthraquinone

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Identifiers

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