nataloe-emodin (CHEBI:152054)

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ChEBI Name	nataloe-emodin

ChEBI ID	CHEBI:152054

Definition	A trihydroxyanthraquinone that is 9,10-anthraquinone which is substituted by hydroxy groups at positions 1, 2, and 8 and by a methyl group at position 6. It is isolated from the leaves of Picramnia sellowii and Picramnia latifolia plants.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C15H10O5

Net Charge

Average Mass

270.240

Monoisotopic Mass

270.05282

InChI

InChI=1S/C15H10O5/c1-6-4-8-11(10(17)5-6)15(20)12-7(13(8)18)2-3-9(16)14(12)19/h2-5,16-17,19H,1H3

InChIKey

WLOSKKPZIOUGFB-UHFFFAOYSA-N

SMILES

C1(=C(C=CC2=C1C(C=3C(=CC(=CC3C2=O)C)O)=O)O)O

Metabolite of Species	Details
Picramnia sellowii (NCBI:txid2686319)	Found in leaf (BTO:0000713). See: PubMed
Picramnia latifolia (NCBI:txid681474)	Found in leaf (BTO:0000713). See: PubMed

Roles Classification
Biological Role(s):	antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	nataloe-emodin (CHEBI:152054) has role antibacterial agent (CHEBI:33282) nataloe-emodin (CHEBI:152054) has role antineoplastic agent (CHEBI:35610) nataloe-emodin (CHEBI:152054) has role plant metabolite (CHEBI:76924) nataloe-emodin (CHEBI:152054) is a trihydroxyanthraquinone (CHEBI:37488) nataloe-emodin (CHEBI:152054) is conjugate acid of nataloe-emodin(1−) (CHEBI:152055)

Incoming	cladofulvin (CHEBI:152056) has functional parent nataloe-emodin (CHEBI:152054) nataloe-emodin(1−) (CHEBI:152055) is conjugate base of nataloe-emodin (CHEBI:152054)

IUPAC Name

1,2,8-trihydroxy-6-methylanthracene-9,10-dione

Synonyms	Sources
1,2,8-trihydroxy-6-methyl-9,10-anthraquinone	ChEBI
1,2,8-trihydroxy-6-methylanthra-9,10-quinone	SUBMITTER
1,2,8-trihydroxy-6-methylanthraquinone	ChEBI
nataloe emodin	ChEBI

Registry Number	Type	Source
478-46-6	CAS Registry Number	ChEBI

Last Modified

03 June 2020