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Compounds

COMPOUND NPA004949

STRUCTURE

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PROPERTIES

NPAID	NPA004949
CLUSTER ID	36
NODE ID	36
NAME	Concentricol
FORMULA	C30H54O6
MOLECULAR WEIGHT (Da)	510.7560
ACCURATE MASS (Da)	510.3920
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Daldinia
ORIGIN SPECIES	concentrica
InChIKey	VZNMYFXGBPEORA-VUHAMLAFSA-N
InChI	InChI=1S/C30H54O6/c1-23(15-17-27(33)29(5,35)19-9-13-25(3)21-31)11-7-8-12-24(2)16-18-28(34)30(6,36)20-10-14-26(4)22-32/h11-14,27-28,31-36H,7-10,15-22H2,1-6H3/b23-11+,24-12+,25-13+,26-14+
SMILES	C/C(=C\CC/C=C(/CCC(O)C(O)(CC/C=C(/CO)\C)C)\C)/CCC(O)C(O)(CC/C=C(/CO)\C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Stadler, Marc; Baumgartner, Manuela; Grothe, Torsten; Muehlbauer, Andrea; Seip, Stephan; Wollweber, Hartmund Concentricol, a taxonomically significant triterpenoid from Daldinia concentrica Phytochemistry 2001 56 (8) 787-793.
DOI	10.1016/s0031-9422(01)00032-2	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Xylariales	MycoBank	37989
Family	Hypoxylaceae	MycoBank	2033035
Genus	Daldinia	MycoBank	42360

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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