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Compounds

COMPOUND NPA011108

STRUCTURE

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PROPERTIES

NPAID	NPA011108
CLUSTER ID	69
NODE ID	64
NAME	Pinicolic acid C
FORMULA	C30H46O4
MOLECULAR WEIGHT (Da)	470.6940
ACCURATE MASS (Da)	470.3396
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Fomitopsis
ORIGIN SPECIES	pinicola
InChIKey	ZOQINMSKLIQAKX-XMWXQHOCSA-N
InChI	InChI=1S/C30H46O4/c1-19(2)9-8-10-21(27(33)34)23-13-17-30(7)25-12-11-22(20(3)4)28(5,16-15-26(31)32)24(25)14-18-29(23,30)6/h9,21-23H,3,8,10-18H2,1-2,4-7H3,(H,31,32)(H,33,34)/t21-,22+,23-,28+,29-,30+/m1/s1
SMILES	CC(=CCC[C@H]([C@H]1CC[C@@]2([C@@]1(CCC3=C2CC[C@H]([C@]3(C)CCC(=O)O)C(=C)C)C)C)C(=O)O)C

ORIGINAL ISOLATION REFERENCE

CITATION	Roesecke, Joachim; Koenig, Wilfried A. Steroids from the fungus Fomitopsis pinicola Phytochemistry 1999 52 (8) 1621-1627.
DOI	10.1016/s0031-9422(99)00349-0	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Basidiomycota	MycoBank	5204
Class	Agaricomycetes	MycoBank	155619
Order	Polyporales	MycoBank	5303
Family	Fomitopsidaceae	MycoBank	1769247
Genus	Fomitopsis	MycoBank	34474

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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