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CHEBI:40199 - 6-(2,4-diamino-6-ethylpyrimidin-5-yl)-4-(3-methoxypropyl)-2,2-dimethyl-2H-1,4-benzoxazin-3(4H)-one

ChEBI IDCHEBI:40199
ChEBI Name6-(2,4-diamino-6-ethylpyrimidin-5-yl)-4-(3-methoxypropyl)-2,2-dimethyl-2H-1,4-benzoxazin-3(4H)-one
Stars
ASCII Name6-(2,4-diamino-6-ethylpyrimidin-5-yl)-4-(3-methoxypropyl)-2,2-dimethyl-2H-1,4-benzoxazin-3(4H)-one
Last Modified17 October 2009
DownloadsMolfile
FormulaC20H27N5O3
Net Charge0
Average Mass385.468
Monoisotopic Mass385.21139
SMILES[H]c1c([H])c(-c2c(N([H])[H])nc(N([H])[H])nc2C([H])([H])C([H])([H])[H])c([H])c2c1OC(C([H])([H])[H])(C([H])([H])[H])C(=O)N2C([H])([H])C([H])([H])C([H])([H])OC([H])([H])[H]
InChIInChI=1S/C20H27N5O3/c1-5-13-16(17(21)24-19(22)23-13)12-7-8-15-14(11-12)25(9-6-10-27-4)18(26)20(2,3)28-15/h7-8,11H,5-6,9-10H2,1-4H3,(H4,21,22,23,24)
InChIKeyWPAPODFGOZXFLG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-(2,4-diamino-6-ethylpyrimidin-5-yl)-4-(3-methoxypropyl)-2,2-dimethyl-2H-1,4-benzoxazin-3(4H)-one (CHEBI:40199) is a aminopyrimidine (CHEBI:38338)
6-(2,4-diamino-6-ethylpyrimidin-5-yl)-4-(3-methoxypropyl)-2,2-dimethyl-2H-1,4-benzoxazin-3(4H)-one (CHEBI:40199) is a benzoxazine (CHEBI:46969)
Synonyms  Source
6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-4-(3-METHOXYPROPYL)-2,2-DIMETHYL-2H-1,4-BENZOXAZIN-3(4H)-ONEPDBeChem
6-(2,4-diamino-6-ethylpyrimidin-5-yl)-4-(3-methoxypropyl)-2,2-dimethyl-2H-1,4-benzoxazin-3(4H)-onePDBeChem
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