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Compounds

COMPOUND NPA002226

STRUCTURE

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PROPERTIES

NPAID	NPA002226
CLUSTER ID	353
NODE ID	318
NAME	Microginin 99-A
FORMULA	C40H58ClN5O8
MOLECULAR WEIGHT (Da)	772.3840
ACCURATE MASS (Da)	771.3974
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Cyanobacterium
ORIGIN SPECIES	sp.
InChIKey	DRNVSYAWHUZNCC-QDALIAGFSA-N
InChI	InChI=1S/C40H58ClN5O8/c1-26(2)22-33(38(51)45(3)35(24-28-14-18-31(48)19-15-28)39(52)46-21-9-11-34(46)40(53)54)44-37(50)32(23-27-12-16-30(47)17-13-27)43-36(49)25-29(42)10-7-5-4-6-8-20-41/h12-19,26,29,32-35,47-48H,4-11,20-25,42H2,1-3H3,(H,43,49)(H,44,50)(H,53,54)/t29-,32+,33+,34+,35+/m1/s1
SMILES	CC(C)C[C@@H](C(=O)N(C)[C@@H](CC1=CC=C(C=C1)O)C(=O)N2CCC[C@H]2C(=O)O)NC(=O)[C@H](CC3=CC=C(C=C3)O)NC(=O)C[C@@H](CCCCCCCCl)N

ORIGINAL ISOLATION REFERENCE

CITATION	Ishida, Keishi; Matsuda, Hisashi; Murakami, Masahiro Four new microginins, linear peptides from the cyanobacterium Microcystis aeruginosa Tetrahedron 1998 54 (44) 13475-13484.
DOI	10.1016/s0040-4020(98)00826-6	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Chroococcales	LPSN	1118
Family	Cyanobacteriaceae	LPSN	-
Genus	Cyanobacterium	LPSN	102234

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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