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Compounds

COMPOUND NPA012374

STRUCTURE

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PROPERTIES

NPAID	NPA012374
CLUSTER ID	167
NODE ID	158
NAME	Asukamycin
FORMULA	C31H34N2O7
MOLECULAR WEIGHT (Da)	546.6200
ACCURATE MASS (Da)	546.2366
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	nodosus subsp. asukaensis
InChIKey	SSHVAUUEPNULMP-PVYHIPRASA-N
InChI	InChI=1S/C31H34N2O7/c34-23-17-18-24(35)27(23)33-26(37)16-10-3-4-11-19-31(39)20-22(28(38)29-30(31)40-29)32-25(36)15-9-2-1-6-12-21-13-7-5-8-14-21/h1-4,6,9-12,15-16,19-21,29-30,34,39H,5,7-8,13-14,17-18H2,(H,32,36)(H,33,37)/b2-1+,4-3-,12-6+,15-9+,16-10+,19-11-/t29?,30?,31-/m0/s1
SMILES	C1CCC(CC1)/C=C/C=C/C=C/C(=O)NC2=C[C@](C3C(C2=O)O3)(/C=C\C=C/C=C/C(=O)NC4=C(CCC4=O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Kakinuma, Katsumi; Ikekawa, Nobuo; Nakagawa, Akira; Omura, Satoshi The structure of asukamycin, a possible shunt metabolite from 3-dehydroquinic acid in the shikimate pathway Journal of the American Chemical Society 1979 101 (12) 3402-3404.
DOI	10.1021/ja00506a056	PMID	-

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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