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Compounds

COMPOUND NPA011684

STRUCTURE

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PROPERTIES

NPAID	NPA011684
CLUSTER ID	171
NODE ID	160
NAME	3α-(3'-butylcarboxyacetoxy)oxepanoquercinic acid C
FORMULA	C38H60O8
MOLECULAR WEIGHT (Da)	644.8900
ACCURATE MASS (Da)	644.4288
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Fomitopsis
ORIGIN SPECIES	rosea
InChIKey	BMOGLDJYNKJONY-TYDKQVDASA-N
InChI	InChI=1S/C38H60O8/c1-10-11-18-44-31(39)20-32(40)45-29-15-16-35(7)27-19-30-37(9)25(22(2)21-38(43,46-30)24(4)23(3)33(41)42)14-17-36(37,8)26(27)12-13-28(35)34(29,5)6/h22-25,28-30,43H,10-21H2,1-9H3,(H,41,42)/t22-,23?,24-,25-,28?,29-,30-,35?,36+,37?,38?/m1/s1
SMILES	CCCCOC(=O)CC(=O)O[C@@H]1CCC2(C(C1(C)C)CCC3=C2C[C@@H]4C5([C@]3(CC[C@@H]5[C@@H](CC(O4)([C@H](C)C(C)C(=O)O)O)C)C)C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Popova, Milena; Trusheva, Boryana; Gyosheva, Melania; Tsvetkova, Iva; Bankova, Vassya Antibacterial triterpenes from the threatened wood-decay fungus Fomitopsis rosea Fitoterapia 2009 80 (5) 263-266.
DOI	10.1016/j.fitote.2009.02.008	PMID	19264113

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Basidiomycota	MycoBank	5204
Class	Agaricomycetes	MycoBank	155619
Order	Polyporales	MycoBank	5303
Family	Fomitopsidaceae	MycoBank	1769247
Genus	Fomitopsis	MycoBank	34474

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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