Hofmeisterin II (CHEBI:67436)

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ChEBI Name	Hofmeisterin II

ChEBI ID	CHEBI:67436

Definition	A natural product found in Eupatorium cannabinum subspecies asiaticum.

Stars	This entity has been manually annotated by a third party.

Supplier Information

Download	Molfile XML SDF

Formula

C18H18O4

Net Charge

Average Mass

298.33310

Monoisotopic Mass

298.12051

InChI

InChI=1S/C18H18O4/c1-11-3-5-13(17(21)9-11)15(19)7-8-16(20)14-6-4-12(2)10-18(14)22/h3-6,9-10,21-22H,7-8H2,1-2H3

InChIKey

VCMZMLWIPPPAOG-UHFFFAOYSA-N

SMILES

Cc1ccc(C(=O)CCC(=O)c2ccc(C)cc2O)c(O)c1

Metabolite of Species	Details
Eupatorium cannabinum subsp. asiaticum (NCBI:txid102770)	Found in aerial part (BTO:0001658). MeOH extract of shade-dried, pulverized aerial parts See: PubMed

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology
Outgoing	Hofmeisterin II (CHEBI:67436) has role metabolite (CHEBI:25212) Hofmeisterin II (CHEBI:67436) is a butanone (CHEBI:22951)

Citation	Type	Source
21391659	PubMed citation	Europe PMC

Last Modified

22 September 2014

General Comment
2014-10-17	Suggested Classification: ISA:acetophenones(CHEBI:22187); ISA:aromatic ketone(CHEBI:76224); ISA:hydroxytoluene(CHEBI:24751); ISA:carbonyl compound(CHEBI:36586); ISA:toluenes(CHEBI:27024); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enol(CHEBI:33823); ISA:organonitrogen compound(CHEBI:35352); ISA:organic heterocyclic compound(CHEBI:24532); ISA:aromatic alcohol(CHEBI:33854);