lyratol D (CHEBI:66608)

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ChEBI Name	lyratol D

ChEBI ID	CHEBI:66608

Definition	A sesquiterpene lactone that is butan-4-olide substituted by geminal methyl groups at position 5 and a 4-hydroxy-2,6-dimethylbenzyl group at position 4. Isolated from Solanum lyratum, it exhibits cytotoxicity against human cancer cell lines.

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

Supplier Information

Download	Molfile XML SDF

Formula

C15H20O3

Net Charge

Average Mass

248.31750

Monoisotopic Mass

248.14124

InChI

InChI=1S/C15H20O3/c1-9-5-12(16)6-10(2)13(9)7-11-8-14(17)18-15(11,3)4/h5-6,11,16H,7-8H2,1-4H3/t11-/m1/s1

InChIKey

JEUPLAJVBQWXMD-LLVKDONJSA-N

SMILES

Cc1cc(O)cc(C)c1C[C@@H]1CC(=O)OC1(C)C

Metabolite of Species	Details
Solanum lyratum (NCBI:txid230192)	Found in whole plant (BTO:0001461). 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.

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

ChEBI Ontology
Outgoing	lyratol D (CHEBI:66608) has role antineoplastic agent (CHEBI:35610) lyratol D (CHEBI:66608) has role metabolite (CHEBI:25212) lyratol D (CHEBI:66608) is a butan-4-olide (CHEBI:22950) lyratol D (CHEBI:66608) is a phenols (CHEBI:33853) lyratol D (CHEBI:66608) is a sesquiterpene lactone (CHEBI:37667)

Synonym	Source
(4R)-4-(4-hydroxy-2,6-dimethylbenzyl)-5,5-dimethyldihydrofuran-2(3H)-one	ChEBI

Registry Number	Type	Source
19683899	Reaxys Registry Number	Reaxys

Citation	Type	Source
19336938	PubMed citation	Europe PMC

Last Modified

27 March 2013