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Compounds

COMPOUND NPA029606

STRUCTURE

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PROPERTIES

NPAID	NPA029606
CLUSTER ID	8719
NODE ID	546
NAME	Ikoamide
FORMULA	C62H107N9O16
MOLECULAR WEIGHT (Da)	1234.5850
ACCURATE MASS (Da)	1233.7836
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Okeania
ORIGIN SPECIES	sp.
InChIKey	FCHLMWAXQCNHTK-MXZYASFVSA-N
InChI	InChI=1S/C62H107N9O16/c1-20-23-43(85-17)33-44(86-18)34-51(75)70(14)53(38(8)21-2)57(78)65-46(35-72)55(76)64-45(30-36(4)5)58(79)68(12)48(31-37(6)7)56(77)66-52(40(10)73)60(81)71(15)54(39(9)22-3)61(82)67(11)47(28-29-50(63)74)59(80)69(13)49(62(83)87-19)32-41-24-26-42(84-16)27-25-41/h24-27,36-40,43-49,52-54,72-73H,20-23,28-35H2,1-19H3,(H2,63,74)(H,64,76)(H,65,78)(H,66,77)/t38-,39-,40+,43+,44-,45+,46+,47-,48-,49-,52-,53+,54-/m0/s1
SMILES	CCC[C@H](C[C@@H](CC(=O)N(C)[C@@H](C(=O)N[C@H](CO)C(=O)N[C@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N(C)[C@H](C(=O)N(C)[C@@H](CCC(N)=O)C(=O)N(C)[C@@H](CC1=CC=C(OC)C=C1)C(=O)OC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)OC)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Iwasaki, Arihiro; Iwasaki, Keitaro; Matsubara, Teruhiko; Nozaki, Tomoyoshi; Saito-Nakano, Yumiko; Sato, Toshinori; Suenaga, Kiyotake; Sumimoto, Shimpei Ikoamide, an Antimalarial Lipopeptide from an Okeania sp. Marine Cyanobacterium Journal of Natural Products 2020 83 (2) 481-488.
DOI	10.1021/acs.jnatprod.9b01147	PMID	32040324

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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