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Compounds

COMPOUND NPA001436

STRUCTURE

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PROPERTIES

NPAID	NPA001436
CLUSTER ID	643
NODE ID	571
NAME	Pyrrolocin B
FORMULA	C26H37NO5
MOLECULAR WEIGHT (Da)	443.5840
ACCURATE MASS (Da)	443.2672
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Unknown-fungus
ORIGIN SPECIES	sp. NRRL 50135
InChIKey	FJSDCBCMOLWEOW-VGFYQSIFSA-N
InChI	InChI=1S/C26H37NO5/c1-15-10-11-20-18(12-15)13-16(2)19(9-7-5-6-8-17(3)29)26(20,4)24(31)22-23(30)21(14-28)27-25(22)32/h5-7,9,13,15,17-21,28-29,31H,8,10-12,14H2,1-4H3,(H,27,32)/b6-5+,9-7+,24-22?/t15-,17+,18-,19+,20-,21+,26-/m0/s1
SMILES	C[C@H]1CC[C@H]2[C@@H](C1)C=C([C@H]([C@]2(C)C(=C3C(=O)[C@H](NC3=O)CO)O)/C=C/C=C/C[C@@H](C)O)C

ORIGINAL ISOLATION REFERENCE

CITATION	Jadulco, Raquel C.; Koch, Michael; Kakule, Thomas B.; Schmidt, Eric W.; Orendt, Anita; He, Haiyin; Janso, Jeffrey E.; Carter, Guy T.; Larson, Erica C.; Pond, Christopher; Matainaho, Teatulohi K.; Barrows, Louis R. Isolation of pyrrolocins A-C: Cis - And trans -decalin tetramic acid antibiotics from an endophytic fungal-derived pathway Journal of Natural Products 2014 77 (11) 2537-2544.
DOI	10.1021/np500617u	PMID	25351193

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Genus	Unknown-fungus	MycoBank	-

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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