Arugosin G (CHEBI:217243)

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CHEBI:217243 - Arugosin G

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ChEBI ID	CHEBI:217243
ChEBI Name	Arugosin G
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C30H36O6
Net Charge	0
Average Mass	492.612
Monoisotopic Mass	492.25119
SMILES	CC(C)=CCOc1c(C)cc(O)c2c1[C@@H](O)Oc1c(CC=C(C)C)cc(CC=C(C)C)c(O)c1C2=O
InChI	InChI=1S/C30H36O6/c1-16(2)8-10-20-15-21(11-9-17(3)4)29-25(26(20)32)27(33)23-22(31)14-19(7)28(24(23)30(34)36-29)35-13-12-18(5)6/h8-9,12,14-15,30-32,34H,10-11,13H2,1-7H3/t30-/m0/s1
InChIKey	SKRQPJZOWGXGMD-PMERELPUSA-N

Species of Metabolite	Component	Source	Comments
Aspergillus nidulans var. acristatus (ncbitaxon:286159)	-	PubMed (16872131)

ChEBI Ontology

Outgoing Relation(s)
	Arugosin G (CHEBI:217243) is a dibenzooxazepine (CHEBI:53802)

IUPAC Name
1,6,10-trihydroxy-8-methyl-7-(3-methylbut-2-enoxy)-2,4-bis(3-methylbut-2-enyl)-6H-benzo[c][1]benzoxepin-11-one

Manual Xrefs	Databases
10018715	ChemSpider