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Compounds

COMPOUND NPA014185

STRUCTURE

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PROPERTIES

NPAID	NPA014185
CLUSTER ID	5099
NODE ID	3653
NAME	JBIR-96
FORMULA	C27H39N5O11S
MOLECULAR WEIGHT (Da)	641.7000
ACCURATE MASS (Da)	641.2367
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. RI051-SDHV6
InChIKey	IGQWJTOITVEYBJ-GMYCQRIPSA-N
InChI	InChI=1S/C27H39N5O11S/c1-14(2)21(30-19(34)12-17-8-6-5-7-9-17)26(38)29-18(13-44(40,41)42)24(36)32-23-16(4)43-20(35)10-11-28-25(37)22(15(3)33)31-27(23)39/h5-9,14-16,18,21-23,33H,10-13H2,1-4H3,(H,28,37)(H,29,38)(H,30,34)(H,31,39)(H,32,36)(H,40,41,42)/t15-,16+,18+,21-,22+,23-/m0/s1
SMILES	C[C@@H]1[C@@H](C(=O)N[C@@H](C(=O)NCCC(=O)O1)[C@H](C)O)NC(=O)[C@@H](CS(=O)(=O)O)NC(=O)[C@H](C(C)C)NC(=O)CC2=CC=CC=C2

ORIGINAL ISOLATION REFERENCE

CITATION	Ueda, Jun-Ya; Izumikawa, Miho; Kozone, Ikuko; Yamamura, Hideki; Hayakawa, Masayuki; Takagi, Motoki; Shin-Ya, Kazuo A phenylacetylated peptide, JBIR-96, isolated from Streptomyces sp. RI051-SDHV6 Journal of Natural Products 2011 74 (5) 1344-1347.
DOI	10.1021/np200054s	PMID	21491925

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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