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Compounds

COMPOUND NPA010068

STRUCTURE

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PROPERTIES

NPAID	NPA010068
CLUSTER ID	2416
NODE ID	1900
NAME	Lyngbyapeptin D
FORMULA	C36H53N5O6S
MOLECULAR WEIGHT (Da)	683.9160
ACCURATE MASS (Da)	683.3717
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Lyngbya
ORIGIN SPECIES	bouillonii
InChIKey	VAZIRJJDQHGFJU-YMGIVACDSA-N
InChI	InChI=1S/C36H53N5O6S/c1-23(2)20-29(35(44)40(8)32(24(3)4)36(45)41-18-11-12-28(41)33-37-17-19-48-33)39(7)34(43)30(38(6)31(42)21-25(5)46-9)22-26-13-15-27(47-10)16-14-26/h13-17,19,21,23-24,28-30,32H,11-12,18,20,22H2,1-10H3/b25-21+/t28-,29-,30-,32-/m0/s1
SMILES	CC(C)C[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C2=NC=CS2)N(C)C(=O)[C@H](CC3=CC=C(C=C3)OC)N(C)C(=O)/C=C(\C)/OC

ORIGINAL ISOLATION REFERENCE

CITATION	Matthew, Susan; Salvador, Lilibeth A.; Schupp, Peter J.; Paul, Valerie J.; Luesch, Hendrik Cytotoxic halogenated macrolides and modified peptides from the apratoxin-producing marine cyanobacterium Lyngbya bouillonii from Guam Journal of Natural Products 2010 73 (9) 1544-1552.
DOI	10.1021/np1004032	PMID	20704304

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Oscillatoriales	LPSN	1150
Family	Oscillatoriaceae	LPSN	1892254
Genus	Lyngbya	LPSN	28073

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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