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Compounds

COMPOUND NPA022098

STRUCTURE

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PROPERTIES

NPAID	NPA022098
CLUSTER ID	3004
NODE ID	2298
NAME	Phomaketide B
FORMULA	C22H33ClO6
MOLECULAR WEIGHT (Da)	428.9530
ACCURATE MASS (Da)	428.1966
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Phoma
ORIGIN SPECIES	sp. NTOU4195
InChIKey	HVVQOFBOWDNQCO-PIPZUTLJSA-N
InChI	InChI=1S/C22H33ClO6/c1-13(2)6-8-17-21(4,29-17)20-19(26-5)16(10-11-22(20,25)12-23)28-18(24)9-7-15-14(3)27-15/h6-7,9,14-17,19-20,25H,8,10-12H2,1-5H3/b9-7+/t14-,15-,16+,17+,19+,20+,21+,22-/m1/s1
SMILES	C[C@@H]1[C@H](O1)/C=C/C(=O)O[C@H]2CC[C@]([C@@H]([C@H]2OC)[C@@]3([C@@H](O3)CC=C(C)C)C)(CCl)O

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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