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Compounds

COMPOUND NPA022222

STRUCTURE

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PROPERTIES

NPAID	NPA022222
CLUSTER ID	6849
NODE ID	4734
NAME	Hormonemate A
FORMULA	C35H62O15
MOLECULAR WEIGHT (Da)	722.8660
ACCURATE MASS (Da)	722.4089
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Dothiora
ORIGIN SPECIES	sp.
InChIKey	CBQBRADTZCDORL-XCFZNXEZSA-N
InChI	InChI=1S/C35H62O15/c1-11-18(6)25(39)31(41)47-28(20(8)13-3)33(43)49-30(22(10)15-5)35(45)50-29(21(9)14-4)34(44)48-27(19(7)12-2)32(42)46-17-24(38)26(40)23(37)16-36/h18-30,36-40H,11-17H2,1-10H3/t18-,19-,20-,21-,22-,23+,24+,25+,26-,27+,28+,29+,30+/m0/s1
SMILES	CC[C@H](C)[C@H](C(=O)O[C@H]([C@@H](C)CC)C(=O)O[C@H]([C@@H](C)CC)C(=O)O[C@H]([C@@H](C)CC)C(=O)O[C@H]([C@@H](C)CC)C(=O)OC[C@H]([C@H]([C@@H](CO)O)O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Pérez-Bonilla, Mercedes; González-Menéndez, Víctor; Pérez-Victoria, Ignacio; De Pedro, Nuria; Martín, Jesús; Molero-Mesa, Joaquín; Casares-Porcel, Manuel; González-Tejero, María Reyes; Vicente, Francisca; Genilloud, Olga; Tormo, José R.; Reyes, Fernando Hormonemate Derivatives from Dothiora sp., an Endophytic Fungus Journal of Natural Products 2017 80 (4) 845-853.
DOI	10.1021/acs.jnatprod.6b00680	PMID	28277681

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Dothideomycetes	MycoBank	147541
Order	Dothideales	MycoBank	5014
Family	Dothioraceae	MycoBank	64899
Genus	Dothiora	MycoBank	64482

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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