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Compounds

COMPOUND NPA028251

STRUCTURE

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PROPERTIES

NPAID	NPA028251
CLUSTER ID	283
NODE ID	257
NAME	Aeruginosin BH604
FORMULA	C30H48N6O7
MOLECULAR WEIGHT (Da)	604.7490
ACCURATE MASS (Da)	604.3584
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Microcystis
ORIGIN SPECIES	sp.
InChIKey	OIHPUVZVWDKLOQ-NDZBDSPBSA-N
InChI	InChI=1S/C30H48N6O7/c1-3-17(2)26(35-28(42)25(40)13-18-6-9-21(38)10-7-18)29(43)36-23-15-22(39)11-8-19(23)14-24(36)27(41)34-20(16-37)5-4-12-33-30(31)32/h6-7,9-10,17,19-20,22-26,37-40H,3-5,8,11-16H2,1-2H3,(H,34,41)(H,35,42)(H4,31,32,33)/t17-,19-,20-,22+,23-,24-,25-,26-/m0/s1
SMILES	CC[C@H](C)[C@H](NC(=O)[C@@H](O)CC1=CC=C(O)C=C1)C(=O)N1[C@H](C(=O)N[C@H](CO)CCCN=C(N)N)C[C@@H]2CC[C@@H](O)C[C@@H]21

ORIGINAL ISOLATION REFERENCE

CITATION	Hasin, Ohad; Carmeli, Shmuel Isolation and structure elucidation of secondary metabolites from a Microcystis sp. bloom material collected in southern Israel Natural Product Communications 2018 13 (10) 1313-1318.
DOI	10.1177/1934578X1801301020	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	Microcystaceae	LPSN	1890449
Genus	Microcystis	LPSN	1125

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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