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Compounds

COMPOUND NPA010465

STRUCTURE

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PROPERTIES

NPAID	NPA010465
CLUSTER ID	558
NODE ID	497
NAME	(17β,20R,22E,24R)-19-norergosta-1,3,5,7,9,14,22-heptaene
FORMULA	C27H34
MOLECULAR WEIGHT (Da)	358.5690
ACCURATE MASS (Da)	358.2661
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Daldinia
ORIGIN SPECIES	concentrica
InChIKey	DBRICIKZTYJLQL-HXDDMZSUSA-N
InChI	InChI=1S/C27H34/c1-18(2)19(3)10-11-20(4)25-14-15-26-24-13-12-21-8-6-7-9-22(21)23(24)16-17-27(25,26)5/h6-13,15,18-20,25H,14,16-17H2,1-5H3/b11-10+/t19-,20-,25-,27-/m1/s1
SMILES	C[C@H](/C=C/[C@@H](C)C(C)C)[C@H]1CC=C2[C@@]1(CCC3=C2C=CC4=CC=CC=C34)C

ORIGINAL ISOLATION REFERENCE

CITATION	Qin, Xiang-Dong; Liu, Ji-Kai Natural aromatic steroids as potential molecular fossils from the fruiting bodies of the ascomycete Daldinia concentrica Journal of Natural Products 2004 67 (12) 2133-2135.
DOI	10.1021/np049793j	PMID	15620272

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Sordariomycetes	MycoBank	147550
Order	Xylariales	MycoBank	37989
Family	Hypoxylaceae	MycoBank	2033035
Genus	Daldinia	MycoBank	42360

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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