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Compounds

COMPOUND NPA033523

STRUCTURE

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PROPERTIES

NPAID	NPA033523
CLUSTER ID	9638
NODE ID	6443
NAME	Palmerolide C
FORMULA	C33H48N2O7
MOLECULAR WEIGHT (Da)	584.7540
ACCURATE MASS (Da)	584.3462
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Candidatus Synoicihabitans
ORIGIN SPECIES	palmerolidicus
InChIKey	BMKCISMFGDXUPH-MAVXHYCFSA-N
InChI	InChI=1S/C33H48N2O7/c1-23(2)20-30(37)35-19-18-25(4)21-26(5)29-22-24(3)14-10-6-8-12-16-28(42-33(34)40)32(39)27(36)15-11-7-9-13-17-31(38)41-29/h6,10-11,13-15,17-21,26-29,32,36,39H,7-9,12,16,22H2,1-5H3,(H2,34,40)(H,35,37)/b10-6+,15-11+,17-13?,19-18+,24-14-,25-21+/t26-,27+,28+,29-,32-/m1/s1
SMILES	CC(C)=CC(=O)N/C=C/C(C)=C/[C@@H](C)[C@H]1C/C(C)=C\C=C\CCC[C@H](OC(N)=O)[C@H](O)[C@@H](O)/C=C/CCC=CC(=O)O1

ORIGINAL ISOLATION REFERENCE

CITATION	Avalon, Nicole E.; Murray, Alison E.; Daligault, Hajnalka E.; Lo, Chien-Chi; Davenport, Karen W.; Dichosa, Armand E. K.; Chain, Patrick S. G.; Baker, Bill J. Bioinformatic and Mechanistic Analysis of the Palmerolide PKS-NRPS Biosynthetic Pathway From the Microbiome of an Antarctic Ascidian Frontiers in Chemistry 2021 9 802574.
DOI	10.3389/fchem.2021.802574	PMID	35004620

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	Candidatus Synoicihabitans	LPSN	-

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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