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Compounds

COMPOUND NPA031348

STRUCTURE

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PROPERTIES

NPAID	NPA031348
CLUSTER ID	69
NODE ID	64
NAME	(3β,4α,5α)-4,4-Dimethylcholest-8-en-3-OL
FORMULA	C29H50O
MOLECULAR WEIGHT (Da)	414.7180
ACCURATE MASS (Da)	414.3862
ORIGIN ORGANISM TYPE	Bacterium
ORIGIN GENUS	Methylococcus
ORIGIN SPECIES	capsulatus
InChIKey	FYHRVINOXYETMN-HFPXORMNSA-N
InChI	InChI=1S/C29H50O/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)26(30)16-18-29(25,7)24(21)15-17-28(22,23)6/h19-20,22-23,25-26,30H,8-18H2,1-7H3/t20-,22-,23?,25+,26+,28-,29-/m1/s1
SMILES	CC(C)CCC[C@@H](C)[C@H]1CCC2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3

ORIGINAL ISOLATION REFERENCE

CITATION	C. W. BIRD, J. M. LYNCH, F. J. PIRT, W. W. REID, C. J. W. BROOKS & B. S. MIDDLEDITCH Steroids and squalene in Methylococcus capsulatus grown on methane. Nature 1971 230 (5294) 473-474.
DOI	10.1038/230473a0	PMID	4929985

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Bacteria	LPSN	2
Phylum	Proteobacteria	LPSN	1224
Class	Gammaproteobacteria	LPSN	1236
Order	Methylococcales	LPSN	135618
Family	Methylococcaceae	LPSN	403
Genus	Methylococcus	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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