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Compounds

COMPOUND NPA008845

STRUCTURE

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PROPERTIES

NPAID	NPA008845
CLUSTER ID	1589
NODE ID	1304
NAME	Torrubiellone A
FORMULA	C22H29NO7
MOLECULAR WEIGHT (Da)	419.4740
ACCURATE MASS (Da)	419.1944
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Torrubiella
ORIGIN SPECIES	sp. BCC 2165
InChIKey	WXLPIUFTKBWEGE-OKWWDJPNSA-N
InChI	InChI=1S/C22H29NO7/c1-2-15(14-24)7-5-3-4-6-8-18(26)19-20(27)17(13-23(30)21(19)28)22(29)11-9-16(25)10-12-22/h3-8,13,15-16,24-25,27,29-30H,2,9-12,14H2,1H3/b4-3+,7-5+,8-6+
SMILES	CCC(CO)/C=C/C=C/C=C/C(=O)C1=C(C(=CN(C1=O)O)C2(CCC(CC2)O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Isaka, Masahiko; Chinthanom, Panida; Supothina, Sumalee; Tobwor, Punsa; Hywel-Jones, Nigel L. Pyridone and tetramic acid alkaloids from the spider pathogenic fungus Torrubiella sp. BCC 2165 Journal of Natural Products 2010 73 (12) 2057-2060.
DOI	10.1021/np100492j	PMID	21090800

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Hypocreales	MycoBank	5125
Family	Clavicipitaceae	MycoBank	34397
Genus	Torrubiella	MycoBank	475080

CLASSYFIRE

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DESCRIPTION	[[ getValue('description') ]]
KINGDOM	[[ getValue('kingdom') ]]
SUPER CLASS	[[ getValue('superclass') ]]
CLASS	[[ getValue('class') ]]
SUB CLASS	[[ getValue('subclass') ]]
MOLECULAR FRAMEWORK	[[ getValue('molecular_framework') ]]

NP CLASSIFIER

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SUPER CLASS	[[ getValue('superclass_results') ]]
CLASS	[[ getValue('class_results') ]]
PATHWAY	[[ getValue('pathway_results') ]]
IS GLYCOSIDE?	[[ getValue('isglycoside') ]]

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