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Compounds

COMPOUND NPA015322

STRUCTURE

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PROPERTIES

NPAID	NPA015322
CLUSTER ID	450
NODE ID	97
NAME	A82548A
FORMULA	C47H81NO14
MOLECULAR WEIGHT (Da)	884.1580
ACCURATE MASS (Da)	883.5657
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	diastatochromogenes
InChIKey	LFLPRACEAAMLQA-UFCNTBQMSA-N
InChI	InChI=1S/C47H81NO14/c1-10-32(49)22-33-17-14-19-47(61-33)25-37-28(4)35(62-47)24-36-31(21-27(3)45(55)59-36)16-13-11-12-15-26(2)41(52)43(60-39-23-34(50)40(48(8)9)30(6)57-39)42(53)29(5)44(54)46(7,56)20-18-38(51)58-37/h13,16,18,20,26-37,39-45,49-50,52-56H,10-12,14-15,17,19,21-25H2,1-9H3/b16-13+,20-18+/t26-,27-,28+,29+,30-,31+,32+,33+,34-,35-,36-,37-,39-,40+,41-,42+,43+,44-,45?,46+,47+/m0/s1
SMILES	CC[C@H](C[C@H]1CCC[C@]2(O1)C[C@H]3[C@@H]([C@@H](O2)C[C@H]4[C@@H](C[C@@H](C(O4)O)C)/C=C/CCC[C@@H]([C@@H]([C@H]([C@@H]([C@H]([C@@H]([C@](/C=C/C(=O)O3)(C)O)O)C)O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)N(C)C)O)O)C)C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Kirst; Larsen; Paschal; Occolowitz; Creemer; Steiner; Lobkovsky; Clardy Structure of the new spiroketal-macrolide A82548A Journal of Antibiotics 1995 48 (9) 990-996.
DOI	10.7164/antibiotics.48.990	PMID	7592067

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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