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Compounds

COMPOUND NPA008163

STRUCTURE

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PROPERTIES

NPAID	NPA008163
CLUSTER ID	3537
NODE ID	1574
NAME	Calditoglycerocaldarchaeol
FORMULA	C92H174O11
MOLECULAR WEIGHT (Da)	1456.3930
ACCURATE MASS (Da)	1455.3056
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Sulfolobus
ORIGIN SPECIES	sp.
InChIKey	OZGOKOLHFUZHBK-ZQXTUVRUSA-N
InChI	InChI=1S/C92H174O11/c1-66-21-13-29-74(9)82-45-41-78(57-82)33-17-25-70(5)49-53-99-62-86(61-93)101-55-51-72(7)27-19-35-80-43-47-84(59-80)76(11)31-15-23-68(3)39-37-67(2)22-14-30-75(10)83-46-42-79(58-83)34-18-26-71(6)50-54-100-63-87(64-103-91-89(96)88(95)90(97)92(91,98)65-94)102-56-52-73(8)28-20-36-81-44-48-85(60-81)77(12)32-16-24-69(4)40-38-66/h66-91,93-98H,13-65H2,1-12H3/t66?,67?,68?,69?,70?,71?,72?,73?,74?,75?,76?,77?,78?,79?,80?,81?,82?,83?,84?,85?,86?,87?,88-,89-,90-,91?,92+/m0/s1
SMILES	CC1CCCC2CCC(C2)C(C)CCCC(C)CCC(C)CCCC(C)C2CCC(CCCC(C)CCOC(COC3[C@@H](O)[C@H](O)[C@H](O)[C@]3(O)CO)COCCC(C)CCCC3CCC(C3)C(C)CCCC(C)CCC(C)CCCC(C)C3CCC(CCCC(C)CCOC(CO)COCC1)C3)C2

ORIGINAL ISOLATION REFERENCE

CITATION	Bode, Moira l; Buddoo, Subash r; Minnaar, Sanet h; Du plessis, Chris a Extraction, isolation and NMR data of the tetraether lipid calditoglycerocaldarchaeol (GDNT) from Sulfolobus metallicus harvested from a bioleaching reactor Chemistry and Physics of Lipids 2008 154 (2) 94.
DOI	10.1016/j.chemphyslip.2008.02.005	PMID	18339312

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Archaea	LPSN	2157
Phylum	Crenarchaeota	LPSN	28889
Class	Thermoprotei	LPSN	183924
Order	Sulfolobales	LPSN	2281
Family	Sulfolobaceae	LPSN	118883
Genus	Sulfolobus	LPSN	2284

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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