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Compounds

COMPOUND NPA001481

STRUCTURE

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PROPERTIES

NPAID	NPA001481
CLUSTER ID	972
NODE ID	839
NAME	Kibdelone C
FORMULA	C29H28ClNO10
MOLECULAR WEIGHT (Da)	585.9930
ACCURATE MASS (Da)	585.1402
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Kibdelosporangium
ORIGIN SPECIES	sp. (MST-108465)
InChIKey	NEZGGHIIKFHZCZ-GIYNXVAASA-N
InChI	InChI=1S/C29H28ClNO10/c1-4-5-11-20(30)16-17(29(39)31(11)2)23(36)14-9(21(16)34)6-7-10-15(14)24(37)19-25(38)18-22(35)12(32)8-13(33)27(18)41-28(19)26(10)40-3/h12-13,22,32-37H,4-8H2,1-3H3/t12-,13-,22-/m1/s1
SMILES	CCCC1=C(C2=C(C(=C3C(=C2O)CCC4=C(C5=C(C(=C43)O)C(=O)C6=C(O5)[C@@H](C[C@H]([C@H]6O)O)O)OC)O)C(=O)N1C)Cl

ORIGINAL ISOLATION REFERENCE

CITATION	Ratnayake, Ranjala; Lacey, Ernest; Tennant, Shaun; Gill, Jennifer H; Capon, Robert J Kibdelones: novel anticancer polyketides from a rare Australian actinomycete Chemistry - A European Journal 2007 13 (5) 1610-1619.
DOI	10.1002/chem.200601236	PMID	17091523

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	Kibdelosporangium	LPSN	2029

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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