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Compounds

COMPOUND NPA017695

STRUCTURE

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PROPERTIES

NPAID	NPA017695
CLUSTER ID	192
NODE ID	180
NAME	Tirandamycin A
FORMULA	C22H27NO7
MOLECULAR WEIGHT (Da)	417.4580
ACCURATE MASS (Da)	417.1788
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	flaveolus
InChIKey	URGUBECARCAPRI-UYWODMNRSA-N
InChI	InChI=1S/C22H27NO7/c1-10(6-7-13(24)15-14(25)9-23-20(15)27)8-11(2)17-12(3)18-16(26)19-21(4,30-19)22(5,28-17)29-18/h6-8,11-12,17-19,24H,9H2,1-5H3,(H,23,27)/b7-6+,10-8+,15-13+/t11-,12-,17-,18+,19+,21+,22+/m1/s1
SMILES	C[C@H]1[C@H]2C(=O)[C@H]3[C@](O3)([C@](O2)(O[C@@H]1[C@H](C)/C=C(\C)/C=C/C(=C\4/C(=O)CNC4=O)/O)C)C

ORIGINAL ISOLATION REFERENCE

CITATION	MacKellar, FORREST A; Grostic, MARVIN F; Olson, EDWARD C; Wnuk, RICHARD J Tirandamycin. I. Structure assignment Journal of the American Chemical Society 1971 93 (19) 4943-4945.
DOI	10.1021/ja00748a067	PMID	5118218

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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