1,3'-bis(2-deoxy-beta-D-erythro-pentofuranosyl)-6-(5,6-diamino-2-oxo-2,3,4,5-tetrahydropyrimidin-4-yl)-1,3-diazabicyclo[2.2.0]hex-4-en-2-one (CHEBI:132158)

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CHEBI:132158 - 1,3'-bis(2-deoxy-β-D-erythro-pentofuranosyl)-6-(5,6-diamino-2-oxo-2,3,4,5-tetrahydropyrimidin-4-yl)-1,3-diazabicyclo[2.2.0]hex-4-en-2-one

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ChEBI ID	CHEBI:132158
ChEBI Name	1,3'-bis(2-deoxy-β-D-erythro-pentofuranosyl)-6-(5,6-diamino-2-oxo-2,3,4,5-tetrahydropyrimidin-4-yl)-1,3-diazabicyclo[2.2.0]hex-4-en-2-one
Stars
ASCII Name	1,3'-bis(2-deoxy-beta-D-erythro-pentofuranosyl)-6-(5,6-diamino-2-oxo-2,3,4,5-tetrahydropyrimidin-4-yl)-1,3-diazabicyclo[2.2.0]hex-4-en-2-one
Definition	An N-glycosyl compound that is a metabolite produced by the bacterium Mycoplasma genitalium.
Last Modified	8 July 2016
Submitter	Steve
Downloads	Molfile

Formula	C18H26N6O8
Net Charge	0
Average Mass	454.440
Monoisotopic Mass	454.18121
SMILES	NC1=NC(=O)N([C@H]2C[C@H](O)[C@@H](CO)O2)C(C2C=C3N2C(=O)N3[C@H]2C[C@H](O)[C@@H](CO)O2)C1N
InChI	InChI=1S/C18H26N6O8/c19-14-15(24(17(29)21-16(14)20)13-3-8(28)10(5-26)32-13)6-1-11-22(6)18(30)23(11)12-2-7(27)9(4-25)31-12/h1,6-10,12-15,25-28H,2-5,19H2,(H2,20,21,29)/t6?,7-,8-,9+,10+,12+,13+,14?,15?/m0/s1
InChIKey	PJZCWYHLSJIVOD-LSJQNWEUSA-N

Species of Metabolite	Component	Source	Comments
Mycoplasma genitalium (ncbitaxon:2097)	-	PubMed (22817898)

Roles Classification

Chemical Role:	Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:	Mycoplasma genitalium metabolite Any bacterial metabolite produced during a metabolic reaction in Mycoplasma genitalium.

ChEBI Ontology

Outgoing Relation(s)
	1,3'-bis(2-deoxy-β-D-erythro-pentofuranosyl)-6-(5,6-diamino-2-oxo-2,3,4,5-tetrahydropyrimidin-4-yl)-1,3-diazabicyclo[2.2.0]hex-4-en-2-one (CHEBI:132158) has role Mycoplasma genitalium metabolite (CHEBI:131604)
	1,3'-bis(2-deoxy-β-D-erythro-pentofuranosyl)-6-(5,6-diamino-2-oxo-2,3,4,5-tetrahydropyrimidin-4-yl)-1,3-diazabicyclo[2.2.0]hex-4-en-2-one (CHEBI:132158) is a N-glycosyl compound (CHEBI:21731)
	1,3'-bis(2-deoxy-β-D-erythro-pentofuranosyl)-6-(5,6-diamino-2-oxo-2,3,4,5-tetrahydropyrimidin-4-yl)-1,3-diazabicyclo[2.2.0]hex-4-en-2-one (CHEBI:132158) is a aminopyrimidine (CHEBI:38338)
	1,3'-bis(2-deoxy-β-D-erythro-pentofuranosyl)-6-(5,6-diamino-2-oxo-2,3,4,5-tetrahydropyrimidin-4-yl)-1,3-diazabicyclo[2.2.0]hex-4-en-2-one (CHEBI:132158) is a azabicycloalkane (CHEBI:38295)
	1,3'-bis(2-deoxy-β-D-erythro-pentofuranosyl)-6-(5,6-diamino-2-oxo-2,3,4,5-tetrahydropyrimidin-4-yl)-1,3-diazabicyclo[2.2.0]hex-4-en-2-one (CHEBI:132158) is a pyrimidone (CHEBI:38337)

Synonym	Source
dC64dC_dewar	ChEBI

Citations