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Compounds

COMPOUND NPA014191

STRUCTURE

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PROPERTIES

NPAID	NPA014191
CLUSTER ID	1374
NODE ID	1156
NAME	Disydonol C
FORMULA	C30H46O5
MOLECULAR WEIGHT (Da)	486.6930
ACCURATE MASS (Da)	486.3345
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Aspergillus
ORIGIN SPECIES	sp.
InChIKey	IVRQFCVGCSKHLJ-KYJUHHDHSA-N
InChI	InChI=1S/C30H46O5/c1-20(2)9-7-13-29(5,34)25-12-11-22(16-27(25)32)15-23-17-26(28(33)18-24(23)19-31)30(6,35)14-8-10-21(3)4/h11-12,16-18,20-21,31-35H,7-10,13-15,19H2,1-6H3/t29-,30-/m0/s1
SMILES	CC(C)CCC[C@](C)(O)C1=C(O)C=C(CC2=CC([C@@](C)(O)CCCC(C)C)=C(O)C=C2CO)C=C1

ORIGINAL ISOLATION REFERENCE

CITATION	Sun, Ling-Ling; Shao, Chang-Lun; Chen, Jian-Feng; Guo, Zhi-Yong; Fu, Xiu-Mei; Chen, Min; Chen, Yi-Yan; Li, Rui; Voogd, Nicole J. de; She, Zhi-Gang; Lin, Yong-Cheng; Wang, Chang-Yun New bisabolane sesquiterpenoids from a marine-derived fungus Aspergillus sp. isolated from the sponge Xestospongia testudinaria Bioorganic and Medicinal Chemistry Letters 2012 22 (3) 1326-1329.
DOI	10.1016/j.bmcl.2011.12.083	PMID	22225637

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Class	Eurotiomycetes	MycoBank	147545
Order	Eurotiales	MycoBank	5042
Family	Aspergillaceae	MycoBank	1131492
Genus	Aspergillus	MycoBank	5052

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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