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Compounds

COMPOUND NPA025339

STRUCTURE

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PROPERTIES

NPAID	NPA025339
CLUSTER ID	29
NODE ID	28
NAME	Aphidicolin A16
FORMULA	C22H36O6
MOLECULAR WEIGHT (Da)	396.5240
ACCURATE MASS (Da)	396.2512
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Botryotinia
ORIGIN SPECIES	fuckeliana MCCC 3A00494
InChIKey	FGOOUQABRLKGMJ-GZJWPCPGSA-N
InChI	InChI=1S/C22H36O6/c1-13(24)28-12-22(27)7-6-21-10-14(22)8-15(21)16(25)9-17-19(2,11-23)18(26)4-5-20(17,21)3/h14-18,23,25-27H,4-12H2,1-3H3/t14-,15-,16-,17+,18-,19+,20+,21+,22+/m1/s1
SMILES	CC(=O)OC[C@]1(CC[C@]23C[C@H]1C[C@@H]2[C@@H](C[C@@H]4[C@@]3(CC[C@H]([C@@]4(C)CO)O)C)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Niu S; Xia JM; Li Z; Yang LH; Yi ZW; Xie CL; Peng G; Luo ZH; Shao Z; Yang XW Aphidicolin Chemistry of the Deep-Sea-Derived Fungus Botryotinia fuckeliana MCCC 3A00494. Journal of Natural Products 2019 82 (8) 2307-2331.
DOI	10.1021/acs.jnatprod.9b00705	PMID	31403790

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Leotiomycetes	MycoBank	147548
Order	Helotiales	MycoBank	5178
Family	Sclerotiniaceae	MycoBank	28983
Genus	Botryotinia	MycoBank	40558

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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