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Compounds

COMPOUND NPA007681

STRUCTURE

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PROPERTIES

NPAID	NPA007681
CLUSTER ID	1239
NODE ID	1050
NAME	Ansacarbamitocin D
FORMULA	C35H47ClN4O15
MOLECULAR WEIGHT (Da)	799.2270
ACCURATE MASS (Da)	798.2726
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Amycolatopsis
ORIGIN SPECIES	sp.
InChIKey	XPIJOLPXNNKWBT-VEGPDJPXSA-N
InChI	InChI=1S/C35H47ClN4O15/c1-15-7-6-8-22(50-5)35(49)13-20(52-33(48)39-35)16(2)29-34(3,55-29)23(53-32(47)38-4)12-24(43)40(18-10-17(9-15)11-19(42)25(18)36)30-27(45)26(44)28(54-31(37)46)21(14-41)51-30/h6-8,10-11,16,20-23,26-30,41-42,44-45,49H,9,12-14H2,1-5H3,(H2,37,46)(H,38,47)(H,39,48)/b8-6+,15-7+/t16-,20+,21+,22-,23+,26+,27+,28+,29+,30+,34+,35+/m1/s1
SMILES	C[C@@H]1[C@@H]2C[C@]([C@@H](/C=C/C=C(/CC3=CC(=C(C(=C3)O)Cl)N(C(=O)C[C@@H]([C@]4([C@H]1O4)C)OC(=O)NC)[C@@H]5[C@H]([C@@H]([C@H]([C@@H](O5)CO)OC(=O)N)O)O)\C)OC)(NC(=O)O2)O

ORIGINAL ISOLATION REFERENCE

CITATION	Snipes, Carl E; Duebelbeis, Dennis O; Olson, Monica; Hahn, Donald R; Dent, William H; Gilbert, Jeffrey R; Werk, Todd L; Davis, George E; Lee-Lu, Rebecca; Graupner, Paul R The ansacarbamitocins: polar ansamitocin derivatives Journal of Natural Products 2007 70 (10) 1578-1581.
DOI	10.1021/np070275t	PMID	17892263

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Pseudonocardiales	LPSN	85010
Family	Pseudonocardiaceae	LPSN	2070
Genus	Amycolatopsis	LPSN	1813

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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