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Compounds

COMPOUND NPA001096

STRUCTURE

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PROPERTIES

NPAID	NPA001096
CLUSTER ID	751
NODE ID	654
NAME	Polyketomycin
FORMULA	C44H48O18
MOLECULAR WEIGHT (Da)	864.8500
ACCURATE MASS (Da)	864.2841
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. (MK277-AF1)
InChIKey	IFCBPTPGDINHLK-SPJHXACWSA-N
InChI	InChI=1S/C44H48O18/c1-16-9-10-17(2)33(47)28(16)41(53)62-39-21(6)59-27(15-42(39,7)54)60-24-11-12-26(58-20(24)5)61-40-36(50)30(19(4)45)37(51)44(56)38(52)31-22(14-43(40,44)55)18(3)29-32(35(31)49)23(46)13-25(57-8)34(29)48/h9-10,13,20-21,24,26-27,39-40,47,49,51,54-56H,11-12,14-15H2,1-8H3/t20-,21+,24+,26+,27+,39-,40?,42-,43?,44?/m1/s1
SMILES	C[C@@H]1[C@H](CC[C@@H](O1)OC2C(=O)C(=C(C3(C2(CC4=C(C5=C(C(=O)C=C(C5=O)OC)C(=C4C3=O)O)C)O)O)O)C(=O)C)O[C@H]6C[C@@]([C@@H]([C@@H](O6)C)OC(=O)C7=C(C=CC(=C7O)C)C)(C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Momose, Isao; Chen, Wei; Nakamura, Hikaru; Naganawa, Hiroshi; Iinuma, Hironobu; Takeuchi, Tomio Polyketomycin, a new antibiotic from Streptomyces sp. MK277-AF1. II. Structure determination Journal of Antibiotics 1998 51 (1) 26-32.
DOI	10.7164/antibiotics.51.26	PMID	9531984

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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