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Compounds

COMPOUND NPA033176

STRUCTURE

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PROPERTIES

NPAID	NPA033176
CLUSTER ID	9589
NODE ID	6428
NAME	Botcinin K
FORMULA	C22H34O7
MOLECULAR WEIGHT (Da)	410.5070
ACCURATE MASS (Da)	410.2305
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Botrytis
ORIGIN SPECIES	cinerea B05.10
InChIKey	OBRXVVKCKIFOHM-VOBDGNIVSA-N
InChI	InChI=1S/C22H34O7/c1-7-8-9-10-11-12-16(24)27-18-14(3)19-22(6,29-21(18,5)15(4)23)17(25)13(2)20(26)28-19/h11-14,17-19,25H,7-10H2,1-6H3/b12-11+/t13-,14-,17+,18-,19+,21+,22-/m1/s1
SMILES	CCCCC/C=C/C(=O)O[C@@H]1[C@@H](C)[C@@H]2OC(=O)[C@H](C)[C@H](O)[C@@]2(C)O[C@@]1(C)C(C)=O

ORIGINAL ISOLATION REFERENCE

CITATION	Moraga, Javier; Izquierdo-Bueno Reina, Inmaculada; Pinedo, Cristina; Hernández-Galán, Rosario; Viaud, Muriel; Collado, Isidro G. Impairment of botrydial production in Botrytis cinerea allows the isolation of undescribed polyketides and reveals new insights into the botcinins biosynthetic pathway Phytochemistry 2021 183 (None) None.
DOI	10.1016/j.phytochem.2020.112627	PMID	33429353

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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