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Compounds

COMPOUND NPA033019

STRUCTURE

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PROPERTIES

NPAID	NPA033019
CLUSTER ID	1662
NODE ID	1358
NAME	Premetathramycin
FORMULA	C48H64O21
MOLECULAR WEIGHT (Da)	977.0190
ACCURATE MASS (Da)	976.3940
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	albus J1074::MMY (eDNA)
InChIKey	GHIYXVPLQFUOCR-ILKRYEEZSA-N
InChI	InChI=1S/C48H64O21/c1-17-26(66-31-15-46(7,59)42(55)21(5)64-31)12-24-10-23-11-25-41(61-9)40(54)33(18(2)49)44(57)48(25,45(58)35(23)39(53)34(24)36(17)50)69-30-14-28(38(52)20(4)63-30)67-29-13-27(37(51)19(3)62-29)68-32-16-47(8,60)43(56)22(6)65-32/h10,12,19-22,25,27-32,37-38,41-43,50-53,55-57,59-60H,11,13-16H2,1-9H3/t19-,20-,21-,22-,25?,27-,28?,29+,30+,31+,32+,37+,38-,41+,42-,43-,46+,47+,48?/m1/s1
SMILES	CO[C@@H]1C(=O)C(C(C)=O)=C(O)C2(O[C@H]3CC(O[C@H]4C[C@@H](O[C@H]5C[C@](C)(O)[C@H](O)[C@@H](C)O5)[C@@H](O)[C@@H](C)O4)[C@H](O)[C@@H](C)O3)C(=O)C3=C(C=C4C=C(O[C@H]5C[C@](C)(O)[C@H](O)[C@@H](C)O5)C(C)=C(O)C4=C3O)CC12

ORIGINAL ISOLATION REFERENCE

CITATION	Stevenson, Luke J.; Bracegirdle, Joe; Liu, Liwei; Sharrock, Abigail V.; Ackerley, David F.; Keyzers, Robert A.; Owen, Jeremy G. Metathramycin, a new bioactive aureolic acid discovered by heterologous expression of a metagenome derived biosynthetic pathway. RSC Chemical Biology 2021 2 (2) 556-567.
DOI	10.1039/d0cb00228c	PMID	-

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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