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Compounds

COMPOUND NPA015048

STRUCTURE

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PROPERTIES

NPAID	NPA015048
CLUSTER ID	854
NODE ID	739
NAME	Sansanmycin I
FORMULA	C44H49N9O11
MOLECULAR WEIGHT (Da)	879.9280
ACCURATE MASS (Da)	879.3552
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. SS
InChIKey	ZNZNMFXEMFQCEI-MEQDLJNYSA-N
InChI	InChI=1S/C44H49N9O11/c1-24(52(2)40(59)31(45)18-26-11-8-12-28(54)17-26)37(39(58)47-23-29-21-35(55)41(64-29)53-16-15-36(56)50-44(53)63)51-38(57)33(19-25-9-4-3-5-10-25)48-43(62)49-34(42(60)61)20-27-22-46-32-14-7-6-13-30(27)32/h3-17,22-24,31,33-35,37,41,46,54-55H,18-21,45H2,1-2H3,(H,47,58)(H,51,57)(H,60,61)(H2,48,49,62)(H,50,56,63)/b29-23-/t24-,31-,33-,34-,35+,37-,41+/m0/s1
SMILES	C[C@@H]([C@@H](C(=O)N/C=C\1/C[C@H]([C@@H](O1)N2C=CC(=O)NC2=O)O)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)N[C@@H](CC4=CNC5=CC=CC=C54)C(=O)O)N(C)C(=O)[C@H](CC6=CC(=CC=C6)O)N

ORIGINAL ISOLATION REFERENCE

CITATION	Xie, Yunying; Cai, Qiang; Ren, Hao; Wang, Lifei; Xu, Hongzhang; Hong, Bin; Wu, Linzhuan; Chen, Ruxian NRPS Substrate Promiscuity Leads to More Potent Antitubercular Sansanmycin Analogues Journal of Natural Products 2014 77 (7) 1744-1748.
DOI	10.1021/np5001494	PMID	24964393

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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