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Compounds

COMPOUND NPA012363

STRUCTURE

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PROPERTIES

NPAID	NPA012363
CLUSTER ID	2284
NODE ID	1815
NAME	Neoergosterol
FORMULA	C27H40O
MOLECULAR WEIGHT (Da)	380.6160
ACCURATE MASS (Da)	380.3079
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Phycomyces
ORIGIN SPECIES	blakesleeanus
InChIKey	MNMJPUHGVUDRCV-PBUYBTHQSA-N
InChI	InChI=1S/C27H40O/c1-17(2)18(3)6-7-19(4)25-12-13-26-24-10-8-20-16-21(28)9-11-22(20)23(24)14-15-27(25,26)5/h6-8,10,17-19,21,25-26,28H,9,11-16H2,1-5H3/b7-6+/t18-,19+,21-,25?,26-,27+/m0/s1
SMILES	C[C@H](/C=C/[C@H](C)C(C)C)C1CC[C@@H]2[C@@]1(CCC3=C2C=CC4=C3CC[C@@H](C4)O)C

ORIGINAL ISOLATION REFERENCE

CITATION	Barrero; Enrique Oltra; Poyatos; Jimenez; Oliver Phycomysterols and other sterols from the Fungus phycomyces blakesleeanus Journal of Natural Products 1998 61 (12) 1491-1496.
DOI	10.1021/np980199h	PMID	9868149

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Mucoromycota	MycoBank	1913637
Class	Mucoromycetes	MycoBank	2212703
Order	Mucorales	MycoBank	4827
Family	Phycomycetaceae	MycoBank	1344966
Genus	Phycomyces	MycoBank	4836

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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