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Compounds

COMPOUND NPA021073

STRUCTURE

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PROPERTIES

NPAID	NPA021073
CLUSTER ID	307
NODE ID	279
NAME	Deltamycin A2
FORMULA	C40H63NO16
MOLECULAR WEIGHT (Da)	813.9350
ACCURATE MASS (Da)	813.4147
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	halstedii subsp. deltae
InChIKey	FXALCAYPJGPQOF-CZCCRFTESA-N
InChI	InChI=1S/C40H63NO16/c1-11-30(45)55-38-23(5)51-32(19-40(38,7)48)56-35-22(4)52-39(34(47)33(35)41(8)9)57-36-25(14-15-42)16-20(2)26(44)12-13-27-28(54-27)17-21(3)50-31(46)18-29(37(36)49-10)53-24(6)43/h12-13,15,20-23,25,27-29,32-39,47-48H,11,14,16-19H2,1-10H3/b13-12+/t20-,21+,22-,23+,25-,27+,28+,29+,32-,33+,34+,35-,36-,37-,38+,39-,40-/m1/s1
SMILES	CCC(=O)O[C@H]1[C@@H](O[C@@H](C[C@@]1(C)O)O[C@@H]2[C@H](O[C@@H]([C@H]([C@@H]2N(C)C)O)O[C@@H]3[C@@H](C[C@H](C(=O)/C=C/[C@H]4[C@@H](O4)C[C@@H](OC(=O)C[C@@H]([C@H]3OC)OC(=O)C)C)C)CC=O)C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Shimauchi Y; Kubo K; Osumi K; Okamura K; Fukagawa Y; Ishikura T; Lein J Deltamycins, new macrolide antibiotics. III. Chemical structures. Journal of Antibiotics 1979 32 (9) 878-883.
DOI	10.7164/antibiotics.32.878	PMID	511779

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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