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Compounds

COMPOUND NPA029910

STRUCTURE

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PROPERTIES

NPAID	NPA029910
CLUSTER ID	8771
NODE ID	5919
NAME	Kurahyne B
FORMULA	C46H76N6O7
MOLECULAR WEIGHT (Da)	825.1490
ACCURATE MASS (Da)	824.5775
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Okeania
ORIGIN SPECIES	sp.
InChIKey	MRAAWPUFCZEHDM-SHRBXBQQSA-N
InChI	InChI=1S/C46H76N6O7/c1-15-19-20-21-24-33(11)41(54)47-37(31(9)16-2)43(56)50(14)40(32(10)17-3)45(58)48(12)38(29(5)6)44(57)49(13)39(30(7)8)46(59)52-28-23-26-35(52)42(55)51-27-22-25-34(51)36(53)18-4/h1,24,29-32,34-35,37-40H,16-23,25-28H2,2-14H3,(H,47,54)/b33-24+/t31-,32-,34-,35-,37-,38-,39-,40-/m0/s1
SMILES	C#CCCC/C=C(\C)C(=O)N[C@H](C(=O)N(C)[C@H](C(=O)N(C)[C@H](C(=O)N(C)[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)CC)C(C)C)C(C)C)[C@@H](C)CC)[C@@H](C)CC

ORIGINAL ISOLATION REFERENCE

CITATION	Okamoto, S; Iwasaki, A; Ohno, O; Suenaga, K Isolation and Structure of Kurahyne B and Total Synthesis of the Kurahynes. Journal of Natural Products 2015 78 (11) 2719-2725.
DOI	10.1021/acs.jnatprod.5b00662	PMID	26539973

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	Okeania	LPSN	1458928

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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