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Compounds

COMPOUND NPA012049

STRUCTURE

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PROJECT MOLECULE TO GLOBAL VIEW	See Global

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PROPERTIES

NPAID	NPA012049
CLUSTER ID	4577
NODE ID	511
NAME	Variecoacetal A
FORMULA	C27H42O3
MOLECULAR WEIGHT (Da)	414.6300
ACCURATE MASS (Da)	414.3134
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Emericella
ORIGIN SPECIES	aurantio IFM42008
InChIKey	YYCGJHMXNRCONF-HKMPXQLFSA-N
InChI	InChI=1S/C27H42O3/c1-16(2)18-10-11-25(4)12-13-26(5)15-20-17(3)14-27(29-7)22(20)19(24(28-6)30-27)8-9-21(26)23(18)25/h8,17-18,20-24H,1,9-15H2,2-7H3/b19-8+/t17-,18+,20-,21-,22-,23-,24-,25-,26+,27+/m0/s1
SMILES	C[C@H]1C[C@@]2([C@@H]/3[C@H]1C[C@]4(CC[C@@]5(CC[C@@H]([C@H]5[C@@H]4C/C=C3/[C@H](O2)OC)C(=C)C)C)C)OC

ORIGINAL ISOLATION REFERENCE

CITATION	Fujimoto, H; Nakamura, E; Okuyama, E; Ishibashi, M Immunomodulatory constituents from an ascomycete, Emericella aurantio-brunnea Chemical and Pharmaceutical Bulletin 2000 48 (10) 1436-1441.
DOI	10.1248/cpb.48.1436	PMID	11045446

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	Trichocomaceae	MycoBank	28568
Genus	Emericella	MycoBank	5071

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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