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Compounds

COMPOUND NPA004153

STRUCTURE

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PROPERTIES

NPAID	NPA004153
CLUSTER ID	46
NODE ID	11
NAME	Langkocycline A2
FORMULA	C43H56O17
MOLECULAR WEIGHT (Da)	844.9040
ACCURATE MASS (Da)	844.3518
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. Acta 3034
InChIKey	DOBHYAQTLZTUTI-JSWZELETSA-N
InChI	InChI=1S/C43H56O17/c1-19-27(57-33-15-26(45)37(47)21(3)55-33)9-11-31(53-19)59-29-16-34(56-22(4)38(29)48)58-28-10-12-32(54-20(28)2)60-43-30(46)17-41(5,51)18-42(43,52)14-13-24-36(43)40(50)23-7-6-8-25(44)35(23)39(24)49/h6-8,13-14,19-22,26-29,31-34,37-38,44-45,47-48,51-52H,9-12,15-18H2,1-5H3/t19-,20+,21+,22-,26+,27-,28+,29-,31-,32+,33-,34+,37+,38-,41+,42+,43+/m1/s1
SMILES	C[C@@H]1[C@@H](CC[C@H](O1)O[C@@H]2C[C@@H](O[C@@H]([C@H]2O)C)O[C@H]3CC[C@@H](O[C@H]3C)O[C@]45C(=O)C[C@](C[C@]4(C=CC6=C5C(=O)C7=C(C6=O)C(=CC=C7)O)O)(C)O)O[C@@H]8C[C@@H]([C@H]([C@@H](O8)C)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Kalyon, Bahar; Tan, Geok-Yuan A; Pinto, John M; Foo, Cheau-Yee; Wiese, Jutta; Imhoff, Johannes F; Suessmuth, Roderich D; Sabaratnam, Vikineswary; Fiedler, Hans-Peter Langkocyclines: Novel angucycline antibiotics from Streptomyces sp. Acta 3034 Journal of Antibiotics 2013 66 (10) 609-616.
DOI	10.1038/ja.2013.53	PMID	23820614

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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