Chem
J-GLOBAL ID:200907006324146960   Nikkaji number:J1.244.473G

[3β-(Hydroxymethyl)-3-methyl-8-[[1-(hydroxymethyl)-2-hydroxyethyl]amino]-3,4-dihydro-2H-1,4-benzoxazine-5-yl]phenyl ketone

2-{[(3R)-5-ベンゾイル-3-(ヒドロキシメチル)-3-メチル-3,4-ジヒドロ-2H-1,4-ベンゾオキサジン-8-イル]アミノ}プロパン-1,3-ジオール
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C20H24N2O5
Molecular formula furigana: C20-H24-N2-O5
Molecular weight: 372.421
InChI: InChI=1S/C20H24N2O5/c1-20(11-25)12-27-19-16(21-14(9-23)10-24)8-7-15(17(19)22-20)18(26)13-5-3-2-4-6-13/h2-8,14,21-25H,9-12H2,1H3/t20-/m1/s1
InChI key: NOHUECNYRUBFHV-HXUWFJFHSA-N
SMILES: C[C@@]1(CO)COc2c(NC(CO)CO)ccc(C(=O)c3ccccc3)c2N1
Systematic name  (3):
  • [3β-(ヒドロキシメチル)-3-メチル-8-[[1-(ヒドロキシメチル)-2-ヒドロキシエチル]アミノ]-3,4-ジヒドロ-2H-1,4-ベンゾオキサジン-5-イル]フェニルケトン
  • 2-{[(3R)-5-ベンゾイル-3-(ヒドロキシメチル)-3-メチル-3,4-ジヒドロ-2H-1,4-ベンゾオキサジン-8-イル]アミノ}プロパン-1,3-ジオール
  • 2-{[(3R)-5-benzoyl-3-(hydroxymethyl)-3-methyl-3,4-dihydro-2H-1,4-benzoxazin-8-yl]amino}propane-1,3-diol
Other name (1):
  • [3β-(Hydroxymethyl)-3-methyl-8-[[1-(hydroxymethyl)-2-hydroxyethyl]amino]-3,4-dihydro-2H-1,4-benzoxazine-5-yl]phenyl ketone
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