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Compounds

COMPOUND NPA029969

STRUCTURE

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PROPERTIES

NPAID	NPA029969
CLUSTER ID	8797
NODE ID	5938
NAME	Spicarin C
FORMULA	C31H32O15
MOLECULAR WEIGHT (Da)	644.5820
ACCURATE MASS (Da)	644.1741
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Spicaria
ORIGIN SPECIES	elegans KLA03
InChIKey	NUECMCRANXGGPO-NFWIRQETSA-N
InChI	InChI=1S/C31H32O15/c1-11-19-10-39-25(21(19)26(42-15(5)34)29(44-17(7)36)23(11)40-13(3)32)27-22-20(31(38-9)46-27)12(2)24(41-14(4)33)30(45-18(8)37)28(22)43-16(6)35/h25,27,31H,10H2,1-9H3/t25-,27+,31+/m1/s1
SMILES	CO[C@H]1O[C@H]([C@@H]2OCC3=C(C)C(OC(C)=O)=C(OC(C)=O)C(OC(C)=O)=C32)C2=C(OC(C)=O)C(OC(C)=O)=C(OC(C)=O)C(C)=C21

ORIGINAL ISOLATION REFERENCE

CITATION	Lin Z; Ma X; Wei H; Li D; Gu Q; Zhu T Spicarins A–D from acetylated extract of fungus Spicaria elegans KLA03 RSC Advances 2015 5 (44) 35262-35266.
DOI	10.1039/c5ra01923k	PMID	-

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Ascomycota	MycoBank	4890
Genus	Spicaria	MycoBank	-

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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