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1-[(4aS,6R,7R,7aR)-1-benzyl-7-hydroxy-2-keto-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3]oxazin-6-yl]pyrimidine-2,4-quinone
SpectraBase Compound ID 3m1XGrwciF5
InChI InChI=1S/C17H17N3O6/c21-12-6-7-19(16(23)18-12)15-14(22)13-11(26-15)9-25-17(24)20(13)8-10-4-2-1-3-5-10/h1-7,11,13-15,22H,8-9H2,(H,18,21,23)/t11-,13+,14-,15-/m1/s1
InChIKey NGTGMONKIJMOCM-FAAHXZRKSA-N
Mol Weight 359.34 g/mol
Molecular Formula C17H17N3O6
Exact Mass 359.111735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JiUQoYpv2zc
Name 1-[(4aS,6R,7R,7aR)-1-benzyl-7-hydroxy-2-keto-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3]oxazin-6-yl]pyrimidine-2,4-quinone
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Formula C17H17N3O6
InChI InChI=1S/C17H17N3O6/c21-12-6-7-19(16(23)18-12)15-14(22)13-11(26-15)9-25-17(24)20(13)8-10-4-2-1-3-5-10/h1-7,11,13-15,22H,8-9H2,(H,18,21,23)/t11-,13+,14-,15-/m1/s1
InChIKey NGTGMONKIJMOCM-FAAHXZRKSA-N
Molecular Weight 359.338 g/mol
SMILES O[C@]1([C@](N2C(NC(C=C2)=O)=O)(O[C@@]2(COC(N([C@]12[H])Cc1ccccc1)=O)[H])[H])[H]
SPLASH splash10-0006-9100000000-a2d70f655f9e38c0559a
Source of Spectrum J-61-6986-25
Synonyms 1-[(4aS,6R,7R,7aR)-1-benzyl-7-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3]oxazin-6-yl]pyrimidine-2,4-dione 1-[(4aS,6R,7R,7aR)-7-hydroxy-2-oxo-1-(phenylmethyl)-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3]oxazin-6-yl]pyrimidine-2,4-dione 1-[(4aS,6R,7R,7aR)-7-oxidanyl-2-oxidanylidene-1-(phenylmethyl)-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3]oxazin-6-yl]pyrimidine-2,4-dione
Wiley ID 1347686