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Compounds

COMPOUND NPA019586

STRUCTURE

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PROPERTIES

NPAID	NPA019586
CLUSTER ID	868
NODE ID	751
NAME	Myxochromide S2
FORMULA	C39H56N6O8
MOLECULAR WEIGHT (Da)	736.9110
ACCURATE MASS (Da)	736.4160
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Stigmatella
ORIGIN SPECIES	aurantiaca DW4/3‚Äì1
InChIKey	XDRGEWSCPMOTER-NDSCBTMZSA-N
InChI	InChI=1S/C39H56N6O8/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-33(47)45(7)34-29(6)53-39(52)30(23-24-32(40)46)43-36(49)28(5)41-35(48)27(4)42-37(50)31(25-26(2)3)44-38(34)51/h9-22,26-31,34H,8,23-25H2,1-7H3,(H2,40,46)(H,41,48)(H,42,50)(H,43,49)(H,44,51)/b10-9+,12-11+,14-13+,16-15+,18-17+,20-19+,22-21+/t27-,28-,29+,30-,31-,34-/m0/s1
SMILES	CC/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C(=O)N(C)[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CC(C)C)C)C)CCC(=O)N)C

ORIGINAL ISOLATION REFERENCE

CITATION	Wenzel, Silke C.; Kunze, Brigitte; Höfle, Gerhard; Silakowski, Barbara; Scharfe, Maren; Blöcker, Helmut; Müller, Rolf Structure and Biosynthesis of Myxochromides S1-3 in Stigmatella aurantiaca: Evidence for an Iterative Bacterial Type I Polyketide Synthase and for Module Skipping in Nonribosomal Peptide Biosynthesis ChemBioChem 2005 6 (2) 375-385.
DOI	10.1002/cbic.200400282	PMID	15651040

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Proteobacteria	LPSN	1224
Class	Deltaproteobacteria	LPSN	28221
Order	Myxococcales	LPSN	29
Family	Archangiaceae	LPSN	39
Genus	Stigmatella	LPSN	40

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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