hamacanthin A (CHEBI:66000)

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ChEBI Name	hamacanthin A

ChEBI ID	CHEBI:66000

Definition	A member of the class of pyrazinones that is 5,6-dihydropyrazin-2(1H)-one substituted at positions 3 and 6 by 6-bromo-1H-indol-3-yl groups. It is an antifungal drug isolated from deep water marine sponge Hamacantha sp.

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

Supplier Information

Download	Molfile XML SDF

Formula

C20H14Br2N4O

Net Charge

Average Mass

486.15900

Monoisotopic Mass

483.95344

InChI

InChI=1S/C20H14Br2N4O/c21-10-1-3-12-14(7-23-16(12)5-10)18-9-25-20(27)19(26-18)15-8-24-17-6-11(22)2-4-13(15)17/h1-8,18,23-24H,9H2,(H,25,27)

InChIKey

MYXLDFYXMNSXDR-UHFFFAOYSA-N

SMILES

Brc1ccc2c(c[nH]c2c1)C1CNC(=O)C(=N1)c1c[nH]c2cc(Br)ccc12

Metabolite of Species	Details
Hamacantha (WORMS:131902)	See: PubMed

Roles Classification
Biological Role(s):	antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. (via alkaloid )

ChEBI Ontology
Outgoing	hamacanthin A (CHEBI:66000) has role antifungal agent (CHEBI:35718) hamacanthin A (CHEBI:66000) has role metabolite (CHEBI:25212) hamacanthin A (CHEBI:66000) is a indole alkaloid (CHEBI:38958) hamacanthin A (CHEBI:66000) is a lactam (CHEBI:24995) hamacanthin A (CHEBI:66000) is a organobromine compound (CHEBI:37141) hamacanthin A (CHEBI:66000) is a pyrazinone (CHEBI:167376)

Incoming	hamacanthin B (CHEBI:66001) is a hamacanthin A (CHEBI:66000)

IUPAC Name

3,6-bis(6-bromo-1H-indol-3-yl)-5,6-dihydropyrazin-2(1H)-one

Registry Number	Type	Source
160098-92-0	CAS Registry Number	ChemIDplus

Last Modified

26 January 2021