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Compounds

COMPOUND NPA013696

STRUCTURE

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PROPERTIES

NPAID	NPA013696
CLUSTER ID	4983
NODE ID	3578
NAME	Mechercharmycin B
FORMULA	C35H36N8O10
MOLECULAR WEIGHT (Da)	728.7190
ACCURATE MASS (Da)	728.2554
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Thermoactinomyces
ORIGIN SPECIES	sp. YM3-251
InChIKey	LNXCNAKRXKEHQH-YRUKQIKQSA-N
InChI	InChI=1S/C35H36N8O10/c1-7-17(4)24(42-30(47)25-26(19-11-9-8-10-12-19)53-33(43-25)22-15-52-34(40-22)35(48)49-6)29(46)41-23(16(2)3)28(45)37-18(5)31-39-21(14-50-31)32-38-20(13-51-32)27(36)44/h8-17,23-24H,5,7H2,1-4,6H3,(H2,36,44)(H,37,45)(H,41,46)(H,42,47)/t17-,23-,24+/m0/s1
SMILES	CC[C@H](C)[C@H](C(=O)N[C@@H](C(C)C)C(=O)NC(=C)C1=NC(=CO1)C2=NC(=CO2)C(=O)N)NC(=O)C3=C(OC(=N3)C4=COC(=N4)C(=O)OC)C5=CC=CC=C5

ORIGINAL ISOLATION REFERENCE

CITATION	Kanoh, Kaneo; Matsuo, Yoshihide; Adachi, Kyoko; Imagawa, Hiroshi; Nishizawa, Mugio; Shizuri, Yoshikazu Mechercharmycins A and B, cytotoxic substances from marine-derived Thermoactinomyces sp. YM3-251 Journal of Antibiotics 2005 58 (4) 289-292.
DOI	10.1038/ja.2005.36	PMID	-

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	Thermoactinomycetaceae	LPSN	186824
Genus	Thermoactinomyces	LPSN	2023

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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