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Compounds

COMPOUND NPA021695

STRUCTURE

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PROPERTIES

NPAID	NPA021695
CLUSTER ID	372
NODE ID	336
NAME	Amycolatopsin C
FORMULA	C47H76O17
MOLECULAR WEIGHT (Da)	913.1080
ACCURATE MASS (Da)	912.5083
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Amycolatopsis
ORIGIN SPECIES	sp. MST-108494
InChIKey	VTVRDHRYRTVEOZ-HFPDYHEDSA-N
InChI	InChI=1S/C47H76O17/c1-25-17-26(2)19-34(49)36(58-11)23-35(30(6)47(55)43(60-13)42(52)46(8,54)37(64-47)15-14-16-56-9)62-44(53)29(5)21-33(57-10)22-32(24-48)20-28(4)40(27(3)18-25)63-45-39(51)38(50)41(59-12)31(7)61-45/h17-22,28,30-31,34-43,45,48-52,54-55H,14-16,23-24H2,1-13H3/b25-17+,26-19?,27-18+,29-21+,32-20-,33-22-/t28?,30-,31-,34?,35?,36?,37-,38-,39-,40?,41-,42-,43-,45-,46-,47+/m1/s1
SMILES	C[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC\2C(/C=C(/C=C(/C=C(/C(=O)OC(CC(C(C=C(/C=C(/C=C2\C)\C)C)O)OC)[C@@H](C)[C@]3([C@@H]([C@H]([C@]([C@H](O3)CCCOC)(C)O)O)OC)O)\C)\OC)\CO)C)O)O)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Khalil, Zeinab G.; Salim, Angela A.; Vuong, Daniel; Crombie, Andrew; Lacey, Ernest; Blumenthal, Antje; Capon, Robert J. Amycolatopsins A-C: Antimycobacterial glycosylated polyketide macrolides from the Australian soil Amycolatopsis sp. MST-108494 Journal of Antibiotics 2017 70 (12) 1097-1103.
DOI	10.1038/ja.2017.119	PMID	29066791

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Pseudonocardiales	LPSN	85010
Family	Pseudonocardiaceae	LPSN	2070
Genus	Amycolatopsis	LPSN	1813

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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