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Compounds

COMPOUND NPA012764

STRUCTURE

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PROPERTIES

NPAID	NPA012764
CLUSTER ID	36
NODE ID	35
NAME	(2S)-3-[(9E,12E,15E)-9,12,15-Octadecatrienoyloxy]-2-(palmitoyloxy)propyl 6-deoxy-2,3-di-O-palmitoyl-6-sulfo-α-D-glucopyranoside
FORMULA	C75H136O14S
MOLECULAR WEIGHT (Da)	1293.9660
ACCURATE MASS (Da)	1292.9651
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Cyanobacterium
ORIGIN SPECIES	scytonema sp. (TAU strain SL-30-1-4)
InChIKey	IGIPAMVOOWTWBP-DYVXTHGOSA-N
InChI	InChI=1S/C75H136O14S/c1-5-9-13-17-21-25-29-33-34-38-39-43-47-51-55-59-68(76)84-63-66(86-69(77)60-56-52-48-44-40-35-30-26-22-18-14-10-6-2)64-85-75-74(89-71(79)62-58-54-50-46-42-37-32-28-24-20-16-12-8-4)73(72(80)67(87-75)65-90(81,82)83)88-70(78)61-57-53-49-45-41-36-31-27-23-19-15-11-7-3/h9,13,21,25,33-34,66-67,72-75,80H,5-8,10-12,14-20,22-24,26-32,35-65H2,1-4H3,(H,81,82,83)/b13-9-,25-21-,34-33-
SMILES	CCCCCCCCCCCCCCCC(=O)OC1C(C(OC(C1OC(=O)CCCCCCCCCCCCCCC)OCC(COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC)OC(=O)CCCCCCCCCCCCCCC)CS(=O)(=O)O)O

ORIGINAL ISOLATION REFERENCE

CITATION	Reshef, V; Mizrachi, E; Maretzki, T; Silberstein, C; Loya, S; Hizi, A; Carmeli, S New acylated sulfoglycolipids and digalactolipids and related known glycolipids from cyanobacteria with a potential to inhibit the reverse transcriptase of HIV-1 Journal of Natural Products 1997 60 (12) 1251-1260.
DOI	10.1021/np970327m	PMID	9428159

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Cyanobacteria	LPSN	1117
Class	Cyanophyceae	LPSN	-
Order	Chroococcales	LPSN	1118
Family	Cyanobacteriaceae	LPSN	-
Genus	Cyanobacterium	LPSN	102234

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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