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Compounds

COMPOUND NPA021074

STRUCTURE

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PROPERTIES

NPAID	NPA021074
CLUSTER ID	307
NODE ID	279
NAME	Deltamycin A1
FORMULA	C39H61NO16
MOLECULAR WEIGHT (Da)	799.9080
ACCURATE MASS (Da)	799.3990
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	halstedii subsp. deltae
InChIKey	BSLHJKFVBDZBEO-UQHFAGRNSA-N
InChI	InChI=1S/C39H61NO16/c1-19-15-25(13-14-41)35(36(48-10)29(52-23(5)42)17-30(45)49-20(2)16-28-27(54-28)12-11-26(19)44)56-38-33(46)32(40(8)9)34(21(3)51-38)55-31-18-39(7,47)37(22(4)50-31)53-24(6)43/h11-12,14,19-22,25,27-29,31-38,46-47H,13,15-18H2,1-10H3/b12-11+/t19-,20-,21-,22+,25+,27+,28-,29+,31+,32-,33+,34-,35+,36-,37-,38+,39+/m1/s1
SMILES	C[C@@H]1C[C@@H]([C@@H]([C@@H]([C@H](CC(=O)O[C@@H](C[C@@H]2[C@@H](O2)/C=C/C1=O)C)OC(=O)C)OC)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)C)O[C@H]4C[C@]([C@@H]([C@@H](O4)C)OC(=O)C)(C)O)N(C)C)O)CC=O

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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