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Compounds

COMPOUND NPA014584

STRUCTURE

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PROPERTIES

NPAID	NPA014584
CLUSTER ID	255
NODE ID	52
NAME	Dihydrobotrydialone
FORMULA	C17H26O6
MOLECULAR WEIGHT (Da)	326.3890
ACCURATE MASS (Da)	326.1729
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Botrytis
ORIGIN SPECIES	cinerea
InChIKey	JKAYIDYCQPINOJ-DQVRROIYSA-N
InChI	InChI=1S/C17H26O6/c1-8-6-10(22-9(2)18)12-15(3,4)7-16(5)14(20)23-13(19)11(8)17(12,16)21/h8,10-13,19,21H,6-7H2,1-5H3/t8-,10+,11-,12+,13+,16-,17-/m1/s1
SMILES	C[C@@H]1C[C@@H]([C@@H]2[C@@]3([C@H]1[C@H](OC(=O)[C@]3(CC2(C)C)C)O)O)OC(=O)C

ORIGINAL ISOLATION REFERENCE

CITATION	Duran-Patron, Rosa; Hernandez-Galan, Rosario; Collado, Isidro G. Secobotrytriendiol and related sesquiterpenoids: New phytotoxic metabolites from Botrytis cinerea Journal of Natural Products 2000 63 (2) 182-184.
DOI	10.1021/np990252h	PMID	10691704

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Leotiomycetes	MycoBank	147548
Order	Helotiales	MycoBank	5178
Family	Sclerotiniaceae	MycoBank	28983
Genus	Botrytis	MycoBank	33196

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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