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Compounds

COMPOUND NPA014880

STRUCTURE

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PROPERTIES

NPAID	NPA014880
CLUSTER ID	298
NODE ID	270
NAME	Neomaclafungin D
FORMULA	C46H80O11
MOLECULAR WEIGHT (Da)	809.1350
ACCURATE MASS (Da)	808.5701
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Actinoalloteichus
ORIGIN SPECIES	sp. NPS702
InChIKey	KNAZAWGMTPIXBR-COFNEBACSA-N
InChI	InChI=1S/C46H80O11/c1-9-34-15-13-11-12-14-16-38(49)32(6)39(50)26-36(54-8)27-40(51)33(7)45(53)30(4)17-22-44(52)55-43-28-46(24-23-29(3)42(57-46)25-35(48)10-2)56-41(21-19-34)37(43)20-18-31(5)47/h11-13,15,17,22,29-43,45,47-51,53H,9-10,14,16,18-21,23-28H2,1-8H3/t29-,30-,31?,32+,33-,34-,35+,36+,37+,38+,39-,40+,41-,42-,43-,45+,46-/m0/s1
SMILES	CC[C@@H]1CC[C@H]2[C@H]([C@H](C[C@]3(O2)CC[C@@H]([C@@H](O3)C[C@@H](CC)O)C)OC(=O)C=C[C@@H]([C@H]([C@H]([C@@H](C[C@@H](C[C@@H]([C@@H]([C@@H](CCC=CC=C1)O)C)O)OC)O)C)O)C)CCC(C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Sato, Seizo; Iwata, Fumie; Yamada, Shoichi; Katayama, Masashi Neomaclafungins A-I: Oligomycin-class macrolides from a marine-derived actinomycete Journal of Natural Products 2012 75 (11) 1974-1982.
DOI	10.1021/np300719g	PMID	23102410

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	Actinoalloteichus	LPSN	65496

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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