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Compounds

COMPOUND NPA032782

STRUCTURE

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PROPERTIES

NPAID	NPA032782
CLUSTER ID	46
NODE ID	11
NAME	Urdamycin E
FORMULA	C44H58O17S
MOLECULAR WEIGHT (Da)	890.9980
ACCURATE MASS (Da)	890.3395
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	fradiae
InChIKey	WDNBUGBJVRAIKE-JGRVRNPESA-N
InChI	InChI=1S/C44H58O17S/c1-18-25(45)9-11-33(56-18)61-44-30(47)16-42(5,53)17-43(44,54)31(62-6)13-24-36(44)41(52)23-8-7-22(39(50)35(23)40(24)51)28-15-29(38(49)21(4)55-28)60-32-12-10-27(19(2)57-32)59-34-14-26(46)37(48)20(3)58-34/h7-8,13,18-21,25-29,32-34,37-38,45-46,48-50,53-54H,9-12,14-17H2,1-6H3/t18-,19-,20+,21+,25-,26+,27-,28+,29+,32-,33-,34-,37+,38+,42-,43+,44-/m0/s1
SMILES	CSC1=CC2=C(C(=O)C3=C(C2=O)C(O)=C([C@H]2C[C@@H](O[C@H]4CC[C@H](O[C@H]5C[C@@H](O)[C@H](O)[C@@H](C)O5)[C@H](C)O4)[C@H](O)[C@@H](C)O2)C=C3)[C@@]2(O[C@H]3CC[C@H](O)[C@H](C)O3)C(=O)C[C@](C)(O)C[C@@]12O

ORIGINAL ISOLATION REFERENCE

CITATION	Rohr, J.; Zeeck, A. Metabolic products of microorganisms. Urdamycins, new angucycline antibiotics from Streptomyces fradiae. II. Structural studies of urdamycins B to F Journal of Antibiotics 1987 40 (4) 459-467.
DOI	10.7164/antibiotics.40.459	PMID	3583915

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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