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Compounds

COMPOUND NPA008502

STRUCTURE

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PROPERTIES

NPAID	NPA008502
CLUSTER ID	83
NODE ID	78
NAME	Phomazine B
FORMULA	C20H22N2O3S2
MOLECULAR WEIGHT (Da)	402.5410
ACCURATE MASS (Da)	402.1072
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Phoma
ORIGIN SPECIES	sp. OUCMDZ-1847
InChIKey	RLFWHXFCMHLBFD-XAMWDVODSA-N
InChI	InChI=1S/C20H22N2O3S2/c1-26-19(11-13-7-4-3-5-8-13)18(25)22-16-14(9-6-10-15(16)23)12-20(22,27-2)17(24)21-19/h3-10,15-16,23H,11-12H2,1-2H3,(H,21,24)/t15-,16-,19+,20+/m0/s1
SMILES	CS[C@@]12CC3=CC=C[C@@H]([C@H]3N1C(=O)[C@@](NC2=O)(CC4=CC=CC=C4)SC)O

ORIGINAL ISOLATION REFERENCE

CITATION	Kong, Fandong; Wang, Yi; Liu, Peipei; Dong, Tianhan; Zhu, Weiming Thiodiketopiperazines from the marine-derived fungus Phoma sp. OUCMDZ-1847 Journal of Natural Products 2014 77 (1) 132-137.
DOI	10.1021/np400802d	PMID	24370114

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Dothideomycetes	MycoBank	147541
Order	Pleosporales	MycoBank	92860
Genus	Phoma	MycoBank	37463

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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