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Compounds

COMPOUND NPA003601

STRUCTURE

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PROPERTIES

NPAID	NPA003601
CLUSTER ID	22
NODE ID	21
NAME	Aigialomycin B
FORMULA	C19H24O8
MOLECULAR WEIGHT (Da)	380.3930
ACCURATE MASS (Da)	380.1471
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aigialus
ORIGIN SPECIES	parvus BCC 5311
InChIKey	NWBBODCXRAHUEM-AUEGCBRDSA-N
InChI	InChI=1S/C19H24O8/c1-9-4-3-5-12(20)17(23)14(22)8-15-18(27-15)11-6-10(25-2)7-13(21)16(11)19(24)26-9/h3,5-7,9,12,14-15,17-18,20-23H,4,8H2,1-2H3/b5-3+/t9-,12-,14-,15+,17+,18+/m0/s1
SMILES	C[C@H]1C/C=C/[C@@H]([C@H]([C@H](C[C@@H]2[C@H](O2)C3=CC(=CC(=C3C(=O)O1)O)OC)O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Isaka, Masahiko; Suyarnsestakorn, Chotika; Tanticharoen, Morakot; Kongsaeree, Palangpon; Thebtaranonth, Yodhathai Aigialomycins A-E, new resorcylic macrolides from the marine mangrove fungus Aigialus parvus Journal of Organic Chemistry 2002 67 (5) 1561-1566.
DOI	10.1021/jo010930g	PMID	11871887

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
Family	Aigialaceae	MycoBank	715274
Genus	Aigialus	MycoBank	193126

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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