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Compounds

COMPOUND NPA028461

STRUCTURE

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PROPERTIES

NPAID	NPA028461
CLUSTER ID	8482
NODE ID	5745
NAME	Weishanmycin A2
FORMULA	C25H32N2O3S2
MOLECULAR WEIGHT (Da)	472.6760
ACCURATE MASS (Da)	472.1854
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. CB02120-2
InChIKey	KGMFJDKXPZXPNQ-KWULUAHZSA-N
InChI	InChI=1S/C25H32N2O3S2/c1-5-6-19-8-7-16(2)11-21-17(3)9-10-25(32-21,14-23(29)30)13-22(28)26-18(4)24-27-20(12-19)15-31-24/h7-8,12,15,18,21H,2-3,5-6,9-11,13-14H2,1,4H3,(H,26,28)(H,29,30)/b8-7+,19-12-/t18-,21-,25+/m1/s1
SMILES	C=C1/C=C/C(CCC)=C\C2=CSC(=N2)[C@@H](C)NC(=O)C[C@]2(CC(=O)O)CCC(=C)[C@@H](C1)S2

ORIGINAL ISOLATION REFERENCE

CITATION	Pan G; Xu Z; Guo Z; Hindra; Ma M; Yang D; Zhou H; Gansemans Y; Zhu X; Huang Y; Zhao LX; Jiang Y; Cheng J; Van Nieuwerburgh F; Suh JW; Duan Y; Shen B Discovery of the leinamycin family of natural products by mining actinobacterial genomes. Proceedings of the National Academy of Sciences of the United States of America 2017 114 (52) E11131-E11140.
DOI	10.1073/pnas.1716245115	PMID	29229819

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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