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Compounds

COMPOUND NPA007510

STRUCTURE

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PROPERTIES

NPAID	NPA007510
CLUSTER ID	46
NODE ID	11
NAME	Actinosporin D
FORMULA	C31H32O12
MOLECULAR WEIGHT (Da)	596.5850
ACCURATE MASS (Da)	596.1894
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Actinokineospora
ORIGIN SPECIES	sp.
InChIKey	ZNZVDVHDXYQEBB-YFWXTRLSSA-N
InChI	InChI=1S/C31H32O12/c1-11-9-14-7-8-16-21(19(14)18(10-11)43-31-29(39)27(37)23(33)13(3)41-31)25(35)15-5-4-6-17(20(15)24(16)34)42-30-28(38)26(36)22(32)12(2)40-30/h4-10,12-13,22-23,26-33,36-39H,1-3H3/t12-,13-,22-,23-,26+,27+,28+,29+,30-,31-/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)C5=C(C=C(C=C5C=C4)C)O[C@H]6[C@@H]([C@@H]([C@H]([C@@H](O6)C)O)O)O)O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Grkovic, Tanja; Abdelmohsen, Usama Ramadan; Othman, Eman Maher; Stopper, Helga; Edrada-Ebel, RuAngelie; Hentschel, Ute; Quinn, Ronald J. Two new antioxidant actinosporin analogues from the calcium alginate beads culture of sponge-associated Actinokineospora sp. strain EG49 Bioorganic and Medicinal Chemistry Letters 2014 24 (21) 5089-5092.
DOI	10.1016/j.bmcl.2014.08.068	PMID	25266784

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Actinobacteria	LPSN	201174
Class	Actinobacteria	LPSN	-
Order	Pseudonocardiales	LPSN	85010
Family	Pseudonocardiaceae	LPSN	2070
Genus	Actinokineospora	LPSN	39845

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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