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Compounds

COMPOUND NPA008083

STRUCTURE

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PROPERTIES

NPAID	NPA008083
CLUSTER ID	58
NODE ID	54
NAME	17-O-demethylgeldanamycin hydroquinone
FORMULA	C28H40N2O9
MOLECULAR WEIGHT (Da)	548.6330
ACCURATE MASS (Da)	548.2734
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp.
InChIKey	SSTZKOMSVQUZSD-LVBRMASUSA-N
InChI	InChI=1S/C28H40N2O9/c1-14-10-18-24(33)19(13-20(31)25(18)34)30-27(35)15(2)8-7-9-21(37-5)26(39-28(29)36)17(4)12-16(3)23(32)22(11-14)38-6/h7-9,12-14,16,21-23,26,31-34H,10-11H2,1-6H3,(H2,29,36)(H,30,35)/b9-7-,15-8+,17-12+/t14-,16+,21+,22+,23-,26+/m1/s1
SMILES	C[C@H]1C[C@@H]([C@@H]([C@H](/C=C(/[C@@H]([C@H](/C=C\C=C(\C(=O)NC2=CC(=C(C(=C2O)C1)O)O)/C)OC)OC(=O)N)\C)C)O)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Tadtong, Sarin; Meksuriyen, Duangdeun; Tanasupawat, Somboon; Isobe, Minoru; Suwanborirux, Khanit Geldanamycin derivatives and neuroprotective effect on cultured P19-derived neurons Bioorganic and Medicinal Chemistry Letters 2007 17 (10) 2939-2943.
DOI	10.1016/j.bmcl.2006.12.041	PMID	17442565

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Streptomycetales	LPSN	85011
Family	Streptomycetaceae	LPSN	2062
Genus	Streptomyces	LPSN	1883

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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