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Compounds

COMPOUND NPA002455

STRUCTURE

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PROPERTIES

NPAID	NPA002455
CLUSTER ID	46
NODE ID	11
NAME	Komodoquinone A
FORMULA	C27H31NO10
MOLECULAR WEIGHT (Da)	529.5420
ACCURATE MASS (Da)	529.1948
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Streptomyces
ORIGIN SPECIES	sp. KS3
InChIKey	QHKOGJYMAOSTLN-UEAQBVAUSA-N
InChI	InChI=1S/C27H31NO10/c1-10-20(30)19(28(3)4)25(35)26(37-10)38-14-7-5-6-11-16(14)24(34)18-17(21(11)31)22(32)12-8-27(2,36)9-13(29)15(12)23(18)33/h5-7,10,13,19-20,25-26,29-30,32-33,35-36H,8-9H2,1-4H3/t10-,13-,19+,20+,25-,26-,27-/m0/s1
SMILES	C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)OC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=C5C[C@](C[C@@H](C5=C4O)O)(C)O)O)O)N(C)C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Itoh, Takuya; Kinoshita, Masahiro; Aoki, Shunji; Kobayashi, Motomasa Komodoquinone A, a Novel Neuritogenic Anthracycline, from Marine Streptomyces sp. KS3 Journal of Natural Products 2003 66 (10) 1373-1377.
DOI	10.1021/np030212k	PMID	14575440

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Streptomycetales	LPSN	85011
Family	Streptomycetaceae	LPSN	2062
Genus	Streptomyces	LPSN	1883

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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