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Compounds

COMPOUND NPA013674

STRUCTURE

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PROPERTIES

NPAID	NPA013674
CLUSTER ID	2403
NODE ID	1891
NAME	13-Cyclopentyl-13-desmethyl-erythromycin
FORMULA	C40H71NO12
MOLECULAR WEIGHT (Da)	758.0030
ACCURATE MASS (Da)	757.4976
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Saccharopolyspora
ORIGIN SPECIES	erythraea
InChIKey	GKJQBFZXGVSLLG-NLQFPUDDSA-N
InChI	InChI=1S/C40H71NO12/c1-20-18-39(8,47)36(53-38-32(44)28(41(10)11)17-21(2)49-38)24(5)33(51-29-19-40(9,48-12)35(45)26(7)50-29)25(6)37(46)52-34(27-15-13-14-16-27)23(4)31(43)22(3)30(20)42/h20-29,31-36,38,43-45,47H,13-19H2,1-12H3/t20-,21?,22+,23-,24+,25-,26?,28?,29?,31-,32?,33+,34+,35?,36-,38?,39-,40?/m1/s1
SMILES	C[C@@H]1C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O[C@@H]([C@@H]([C@@H]([C@H](C1=O)C)O)C)C2CCCC2)C)OC3CC(C(C(O3)C)O)(C)OC)C)OC4C(C(CC(O4)C)N(C)C)O)(C)O

ORIGINAL ISOLATION REFERENCE

CITATION	PACEY, MICHAEL S.; DIRLAM, JOHN P.; GELDART, RODERICK W.; LEADLAY, PETER F.; MCARTHUR, HAMISH A. I.; MCCORMICK, ELLEN L.; MONDAY, ROBERT A.; O'CONNELL, THOMAS N.; STAUNTON, JAMES; WINCHESTER, TOBY J. Novel Erythromycins from a Recombinant Saccharopolyspora erythraea Strain NRRL 2338 pIG1. I. Fermentation, Isolation and Biological Activity Journal of Antibiotics 1998 51 (11) 1029-1034.
DOI	10.7164/antibiotics.51.1029	PMID	9918396

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Pseudonocardiales	LPSN	85010
Family	Pseudonocardiaceae	LPSN	2070
Genus	Saccharopolyspora	LPSN	1835

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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