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Compounds

COMPOUND NPA013548

STRUCTURE

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PROPERTIES

NPAID	NPA013548
CLUSTER ID	752
NODE ID	655
NAME	Demethyltrichodimerol
FORMULA	C27H30O8
MOLECULAR WEIGHT (Da)	482.5290
ACCURATE MASS (Da)	482.1941
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Trichoderma
ORIGIN SPECIES	sp. USF-2690
InChIKey	ULPDBVGKXVRYQX-NJLDYWKQSA-N
InChI	InChI=1S/C27H30O8/c1-6-8-10-12-14(28)16-18-19-20(30)17(15(29)13-11-9-7-2)21-23(3,22(16)31)27(33)24(18,4)34-26(19,32)25(21,5)35-27/h6-13,18-19,21,28-29,32-33H,1-5H3/b8-6+,9-7+,12-10+,13-11+,16-14-,17-15+/t18?,19-,21?,23-,24+,25+,26-,27-/m1/s1
SMILES	C/C=C/C=C/C(=C/1\C2[C@@H]3C(=O)/C(=C(/C=C/C=C/C)\O)/C4[C@](C1=O)([C@@]5([C@]2(O[C@]3([C@]4(O5)C)O)C)O)C)/O

ORIGINAL ISOLATION REFERENCE

CITATION	Abe, Naoki; Murata, Takashi; Hirota, Akira Novel DPPH Radical Scavengers, Bisorbicillinol and Demethyltrichodimerol, from a Fungus Bioscience Biotechnology and Biochemistry 1998 62 (4) 661-666.
DOI	10.1271/bbb.62.661	PMID	27392553

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	Hypocreaceae	MycoBank	5129
Genus	Trichoderma	MycoBank	5543

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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