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Compounds

COMPOUND NPA013569

STRUCTURE

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PROPERTIES

NPAID	NPA013569
CLUSTER ID	1542
NODE ID	1266
NAME	Iso-migrastatin
FORMULA	C27H39NO7
MOLECULAR WEIGHT (Da)	489.6090
ACCURATE MASS (Da)	489.2727
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	platensis NRRL18993
InChIKey	TYTDEHCAAKKYOG-ZTTCWHDESA-N
InChI	InChI=1S/C27H39NO7/c1-17(21(29)11-9-10-20-15-23(30)28-24(31)16-20)14-18(2)27-19(3)26(33)22(34-4)12-7-5-6-8-13-25(32)35-27/h7-8,12-14,17,19-20,22,26-27,33H,5-6,9-11,15-16H2,1-4H3,(H,28,30,31)/b12-7+,13-8+,18-14+/t17-,19-,22-,26-,27?/m0/s1
SMILES	C[C@H]1[C@@H]([C@H](/C=C/CC/C=C/C(=O)OC1/C(=C/[C@H](C)C(=O)CCCC2CC(=O)NC(=O)C2)/C)OC)O

ORIGINAL ISOLATION REFERENCE

CITATION	Ju, Jianhua; Lim, Si-Kyu; Jiang, Hui; Shen, Ben Migrastatin and dorrigocins are shunt metabolites of iso-migrastatin Journal of the American Chemical Society 2005 127 (6) 1622-1623.
DOI	10.1021/ja043808i	PMID	15700980

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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