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Compounds

COMPOUND NPA015276

STRUCTURE

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PROPERTIES

NPAID	NPA015276
CLUSTER ID	5347
NODE ID	755
NAME	Peniciadametizine B
FORMULA	C22H26N2O9S
MOLECULAR WEIGHT (Da)	494.5220
ACCURATE MASS (Da)	494.1359
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Penicillium
ORIGIN SPECIES	adametzioides AS-53
InChIKey	HBXKCYHTTYDURW-WDJDBVHOSA-N
InChI	InChI=1S/C22H26N2O9S/c1-23-12(9-11-5-7-14(31-2)17(32-3)16(11)27)19(28)24-22(34-4,20(23)29)10-21(30)15(26)8-6-13(25)18(21)33-24/h5-9,13,15,18,25-27,30H,10H2,1-4H3/b12-9-/t13-,15-,18+,21+,22-/m1/s1
SMILES	CN1/C(=C\C2=C(C(=C(C=C2)OC)OC)O)/C(=O)N3[C@](C1=O)(C[C@@]4([C@@H](C=C[C@H]([C@@H]4O3)O)O)O)SC

ORIGINAL ISOLATION REFERENCE

CITATION	Liu, Yang; Mándi, Attila; Li, Xiao-Ming; Meng, Ling-Hong; Kurtán, Tibor; Wang, Bin-Gui Peniciadametizine A, a dithiodiketopiperazine with a unique spiro[furan-2,7′-pyrazino[1,2-b][1,2]oxazine] skeleton, and a related analogue, peniciadametizine B, from the marine sponge-derived fungus Penicillium adametzioides Marine Drugs 2015 13 (6) 3640-3652.
DOI	10.3390/md13063640	PMID	26058014

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Eurotiomycetes	MycoBank	147545
Order	Eurotiales	MycoBank	5042
Family	Aspergillaceae	MycoBank	1131492
Genus	Penicillium	MycoBank	5073

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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