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Compounds

COMPOUND NPA012613

STRUCTURE

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PROPERTIES

NPAID	NPA012613
CLUSTER ID	248
NODE ID	11
NAME	Gageopeptide B
FORMULA	C39H72N4O9
MOLECULAR WEIGHT (Da)	741.0240
ACCURATE MASS (Da)	740.5299
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Bacillus
ORIGIN SPECIES	sp. SNA-60-367
InChIKey	DXCGBYCPMYNZGA-IQNMQHFLSA-N
InChI	InChI=1S/C39H72N4O9/c1-10-28(8)17-15-13-11-12-14-16-18-29(44)24-34(45)40-30(19-20-35(46)52-9)36(47)41-31(21-25(2)3)37(48)42-32(22-26(4)5)38(49)43-33(39(50)51)23-27(6)7/h25-33,44H,10-24H2,1-9H3,(H,40,45)(H,41,47)(H,42,48)(H,43,49)(H,50,51)/t28?,29-,30+,31+,32+,33+/m1/s1
SMILES	CCC(C)CCCCCCCC[C@H](CC(=O)N[C@@H](CCC(=O)OC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Tareq, Fakir Shahidullah; Lee, Min Ah; Lee, Hyi-Seung; Lee, Yeon-Ju; Lee, Jong Seok; Hasan, Choudhury M.; Islam, Md. Tofazzal; Shin, Hee Jae Non-cytotoxic antifungal agents: Isolation and structures of gageopeptides A-D from a bacillus strain 109GGC020 Journal of Agricultural and Food Chemistry 2014 62 (24) 5565-5572.
DOI	10.1021/jf502436r	PMID	24857413

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Firmicutes	LPSN	1239
Class	Bacilli	LPSN	91061
Order	Bacillales	LPSN	1385
Family	Bacillaceae	LPSN	186817
Genus	Bacillus	LPSN	1386

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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