Natural Products Atlas | Compounds

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Compounds

ID	Spectrum Quality	Annotated Name
CCMSLIB00004688738	Gold	3
CCMSLIB00004688739	Gold	3
CCMSLIB00004711503	Gold	3
CCMSLIB00004711504	Gold	3
CCMSLIB00004711505	Gold	3
CCMSLIB00004711506	Gold	3
CCMSLIB00004711507	Gold	3
CCMSLIB00004711508	Gold	3
CCMSLIB00004711509	Gold	3
CCMSLIB00004711510	Gold	3
CCMSLIB00004711511	Gold	3
CCMSLIB00004711512	Gold	3
CCMSLIB00004711513	Gold	3
CCMSLIB00004711514	Gold	3
CCMSLIB00004711515	Gold	3
CCMSLIB00004711516	Gold	3
CCMSLIB00004711517	Gold	3
CCMSLIB00000853898	Gold	1
CCMSLIB00000853900	Gold	1
CCMSLIB00000850336	Gold	1
CCMSLIB00000855770	Gold	1
CCMSLIB00000850373	Gold	1
CCMSLIB00000850376	Gold	1
CCMSLIB00000855079	Gold	1
CCMSLIB00000855081	Gold	1
CCMSLIB00000855083	Gold	1
CCMSLIB00000849992	Gold	1
CCMSLIB00000849995	Gold	1
CCMSLIB00000478080	Gold	2
CCMSLIB00012131091	Gold	4
CCMSLIB00009970888	Gold	4
CCMSLIB00012132678	Gold	4
CCMSLIB00012132679	Gold	4
CCMSLIB00012132680	Gold	4
CCMSLIB00012132677	Gold	4
CCMSLIB00009972475	Gold	4
CCMSLIB00009972476	Gold	4
CCMSLIB00009972477	Gold	4
CCMSLIB00009972474	Gold	4

COMPOUND NPA032421

STRUCTURE

Image structure

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EXTERNAL LINKS

PROPERTIES

NPAID	NPA032421
CLUSTER ID	1770
NODE ID	1435
NAME	Pseurotin A3
FORMULA	C22H25NO8
MOLECULAR WEIGHT (Da)	431.4410
ACCURATE MASS (Da)	431.1580
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Phoma
ORIGIN SPECIES	sp. NTOU4195
InChIKey	SLYDIPAXCVVRNY-GNPFBFLESA-N
InChI	InChI=1S/C22H25NO8/c1-4-5-11-14(24)15(25)16-12(2)17(26)21(31-16)19(28)22(30-3,23-20(21)29)18(27)13-9-7-6-8-10-13/h5-11,14-15,19,24-25,28H,4H2,1-3H3,(H,23,29)/b11-5-/t14-,15-,19+,21+,22-/m0/s1
SMILES	CC/C=C\[C@H](O)[C@H](O)C1=C(C)C(=O)[C@]2(O1)C(=O)N[C@](OC)(C(=O)C1=CC=CC=C1)[C@@H]2O

ORIGINAL ISOLATION REFERENCE

CITATION	Lee, Ming-Shian; Wang, Shih-Wei; Wang, Guei-Jane; Pang, Ka-Lai; Lee, Ching-Kuo; Kuo, Yueh-Hsiung; Cha, Hyo-Jung; Lin, Ruo-Kai; Lee, Tzong-Huei Angiogenesis Inhibitors and Anti-Inflammatory Agents from Phoma sp. NTOU4195 Journal of Natural Products 2016 79 (12) 2983-2990.
DOI	10.1021/acs.jnatprod.6b00407	PMID	27976895

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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