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Compounds

COMPOUND NPA000215

STRUCTURE

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PROPERTIES

NPAID	NPA000215
CLUSTER ID	181
NODE ID	169
NAME	Ascosteroside
FORMULA	C37H58O9
MOLECULAR WEIGHT (Da)	646.8620
ACCURATE MASS (Da)	646.4081
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Ascotricha
ORIGIN SPECIES	amphitricha
InChIKey	VWTJLWBUAZAHKW-GAWNAFKJSA-N
InChI	InChI=1S/C37H58O9/c1-19(2)20(3)9-10-21(4)26-17-29(39)37(34(42)43)25-12-11-23-22(5)27(14-15-35(23,6)24(25)13-16-36(26,37)7)45-33-31(41)30(40)32(44-8)28(18-38)46-33/h19,21,23,26-33,38-41H,3,5,9-18H2,1-2,4,6-8H3,(H,42,43)/t21-,23-,26+,27-,28+,29+,30+,31+,32+,33-,35-,36+,37+/m0/s1
SMILES	C[C@@H](CCC(=C)C(C)C)[C@H]1C[C@H]([C@@]2([C@@]1(CCC3=C2CC[C@@H]4[C@@]3(CC[C@@H](C4=C)O[C@@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)OC)O)O)C)C)C(=O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Leet, John E.; Huang, Stella; Klohr, Steven E.; McBrien, Kimberly D. Ascosteroside, a new antifungal agent from Ascotricha amphitricha. II. Isolation and structure elucidation Journal of Antibiotics 1996 49 (6) 553-559.
DOI	10.7164/antibiotics.49.553	PMID	8698638

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	Xylariaceae	MycoBank	37990
Genus	Ascotricha	MycoBank	79810

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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