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Compounds

COMPOUND NPA009659

STRUCTURE

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PROPERTIES

NPAID	NPA009659
CLUSTER ID	2654
NODE ID	2062
NAME	CE-108
FORMULA	C37H57NO14
MOLECULAR WEIGHT (Da)	739.8560
ACCURATE MASS (Da)	739.3779
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	diastaticus 108
InChIKey	WENZSKRHIWIHNO-MZMFGJKYSA-N
InChI	InChI=1S/C37H57NO14/c1-4-26-27(41)17-23(39)14-12-15-24(40)19-37(48)20-28(42)30(34(45)46)29(52-37)18-25(51-36-33(44)31(38)32(43)22(3)50-36)16-11-9-7-5-6-8-10-13-21(2)49-35(26)47/h5-11,16,21-22,24-33,36,40-44,48H,4,12-15,17-20,38H2,1-3H3,(H,45,46)/b6-5+,9-7+,10-8+,16-11+/t21-,22?,24?,25+,26?,27?,28+,29+,30-,31?,32?,33?,36?,37-/m1/s1
SMILES	CCC1C(CC(=O)CCCC(C[C@@]2(C[C@@H]([C@H]([C@@H](O2)C[C@H](/C=C/C=C/C=C/C=C/C[C@H](OC1=O)C)OC3C(C(C(C(O3)C)O)N)O)C(=O)O)O)O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Perez-Zuniga, Francisco J.; Seco, Elena M.; Cuesta; Degenhardt, Falco; Rohr, Jorgen; Vallin, Carlos; Iznaga, Yanelis; Perez, Marta E.; Gonzalez, Leonora; Malpartida, Francisco CE-108, a new macrolide tetraene antibiotic Journal of Antibiotics 2004 57 (3) 197-204.
DOI	10.7164/antibiotics.57.197	PMID	15152805

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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