CHEBI:66396 - monodictyochromone A

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ChEBI Name monodictyochromone A
ChEBI ID CHEBI:66396
Definition A chromanone isolated from the marine derived fungus Monodictys putredinis and exhibits inhibitory activity against P450.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C30H30O11
Net Charge 0
Average Mass 566.55260
Monoisotopic Mass 566.17881
InChI InChI=1S/C30H30O11/c1-12-7-15(31)23-17(33)10-30(4,28-16(32)9-21(36)39-28)41-26(23)22(12)14-5-6-19-24(25(14)37)18(34)11-29(3,40-19)27-13(2)8-20(35)38-27/h5-7,13,16,27-28,31-32,37H,8-11H2,1-4H3/t13-,16+,27+,28+,29+,30-/m0/s1
InChIKey PWCVOPRZVQEZQR-QICUOKTJSA-N
SMILES [H][C@]1(OC(=O)C[C@@H]1C)[C@@]1(C)CC(=O)c2c(O1)ccc(c2O)-c1c(C)cc(O)c2C(=O)C[C@](C)(Oc12)[C@]1([H])OC(=O)C[C@H]1O
Metabolite of Species Details
Monodictys putredinis (WORMS:100530) See: PubMed
Roles Classification
Biological Role(s): P450 inhibitor
An enzyme inhibitor that interferes with the activity of cytochrome P450 involved in catalysis of organic substances.
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing monodictyochromone A (CHEBI:66396) has role antineoplastic agent (CHEBI:35610)
monodictyochromone A (CHEBI:66396) has role metabolite (CHEBI:25212)
monodictyochromone A (CHEBI:66396) has role P450 inhibitor (CHEBI:50183)
monodictyochromone A (CHEBI:66396) is a γ-lactone (CHEBI:37581)
monodictyochromone A (CHEBI:66396) is a chromanone (CHEBI:38763)
monodictyochromone A (CHEBI:66396) is a secondary alcohol (CHEBI:35681)
IUPAC Name
(2R,2'S)-5,5'-dihydroxy-2'-[(2R,3R)-3-hydroxy-5-oxotetrahydrofuran-2-yl]-2,2',7'-trimethyl-2-[(2R,3S)-3-methyl-5-oxotetrahydrofuran-2-yl]-2,2',3,3'-tetrahydro-4H,4'H-6,8'-bichromene-4,4'-dione
Citation Waiting for Citations Type Source
18939864 PubMed citation Europe PMC
Last Modified
21 August 2013