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Compounds

COMPOUND NPA008051

STRUCTURE

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PROPERTIES

NPAID	NPA008051
CLUSTER ID	57
NODE ID	53
NAME	Phomacin B
FORMULA	C25H37NO5
MOLECULAR WEIGHT (Da)	431.5730
ACCURATE MASS (Da)	431.2672
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Phoma
ORIGIN SPECIES	sp.
InChIKey	IXONDWQZWWLZDF-LWCQKGSWSA-N
InChI	InChI=1S/C25H37NO5/c1-14(2)8-21-23-17(5)16(4)11-19-10-15(3)9-18(13-27)12-20(28)6-7-22(29)31-25(19,23)24(30)26-21/h6-7,10-11,14,17-21,23,27-28H,8-9,12-13H2,1-5H3,(H,26,30)/b7-6-,15-10-/t17-,18+,19+,20-,21+,23+,25+/m1/s1
SMILES	C[C@H]1[C@H]2[C@@H](NC(=O)[C@]23[C@@H](/C=C(\C[C@@H](C[C@@H](/C=C\C(=O)O3)O)CO)/C)C=C1C)CC(C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Alvi, Khisal A.; Nair, Bipin; Pu, Henry; Ursino, Rocky; Gallo, Cathy; Mocek, Ursula Phomacins: Three Novel Antitumor Cytochalasan Constituents Produced by a Phomasp Journal of Organic Chemistry 1997 62 (7) 2148-2151.
DOI	10.1021/jo962321s	PMID	11671521

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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