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Compounds

COMPOUND NPA024775

STRUCTURE

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PROPERTIES

NPAID	NPA024775
CLUSTER ID	7554
NODE ID	5168
NAME	Mandelalide C
FORMULA	C28H42O10
MOLECULAR WEIGHT (Da)	538.6340
ACCURATE MASS (Da)	538.2778
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Didemnitutus
ORIGIN SPECIES	mandela
InChIKey	AJLATFUSRAYDMR-HRWQENBOSA-N
InChI	InChI=1S/C28H42O10/c1-15-7-5-4-6-8-22-16(2)10-23(37-22)21(31)14-24-26(32)28(34,27(33)38-24)25(35-17(3)29)13-20-12-18(30)11-19(9-15)36-20/h4-7,15-16,18-26,30-32,34H,8-14H2,1-3H3/b6-4-,7-5+/t15-,16+,18-,19+,20+,21+,22+,23+,24+,25-,26-,28-/m0/s1
SMILES	C[C@@H]/1C[C@@H]2C[C@@H](C[C@@H](O2)C[C@@H]([C@@]3([C@H]([C@@H](C[C@H]([C@H]4C[C@H]([C@H](O4)C/C=C\C=C1)C)O)OC3=O)O)O)OC(=O)C)O

ORIGINAL ISOLATION REFERENCE

CITATION	Lopera J; Miller IJ; McPhail KL; Kwan JC Increased Biosynthetic Gene Dosage in a Genome-Reduced Defensive Bacterial Symbiont. mSystems 2017 2 (6) e00096-17.
DOI	10.1128/mSystems.00096-17	PMID	29181447

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Verrucomicrobia	LPSN	74201
Class	Opitutae	LPSN	414999
Order	Opitutales	LPSN	415000
Family	Opitutaceae	LPSN	134623
Genus	Didemnitutus	LPSN	2055839

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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