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Compounds

COMPOUND NPA005639

STRUCTURE

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PROJECT MOLECULE TO GLOBAL VIEW	See Global

EXTERNAL LINKS

PROPERTIES

NPAID	NPA005639
CLUSTER ID	2752
NODE ID	2136
NAME	7alpha-Acetoxydeacetylbotryenedial
FORMULA	C17H24O5
MOLECULAR WEIGHT (Da)	308.3740
ACCURATE MASS (Da)	308.1624
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Daldinia
ORIGIN SPECIES	concentrica
InChIKey	LOZDGOGEQSPGNS-RTNSRKOKSA-N
InChI	InChI=1S/C17H24O5/c1-9-6-12(21)14-13(11(9)7-18)17(5,8-19)15(16(14,3)4)22-10(2)20/h7-9,12,14-15,21H,6H2,1-5H3/t9-,12+,14-,15-,17-/m1/s1
SMILES	C[C@@H]1C[C@@H]([C@@H]2C(=C1C=O)[C@@]([C@@H](C2(C)C)OC(=O)C)(C)C=O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Qin, Xiang-Dong; Shao, Hong-Jun; Dong, Ze-Jun; Liu, Ji-Kai Six New Induced Sesquiterpenes from the Cultures of Ascomycete Daldinia concentrica Journal of Antibiotics 2008 61 (9) 556-562.
DOI	10.1038/ja.2008.74	PMID	19160523

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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