Chem
J-GLOBAL ID：200907013655067935
Nikkaji number：J1.548.701A
(5S)-3-[(S)-1-(Hydroxymethyl)-2-methylpropyl]-5β-(benzyloxy)-5-methyl-6α-(1-propenyl)tetrahydro-2H-1,3-oxazine-2,4-dione
(5S,6S)-5-(ベンジルオキシ)-3-[(2S)-1-ヒドロキシ-3-メチルブタン-2-イル]-5-メチル-6-(プロパ-1-エン-1-イル)-1,3-オキサジナン-2,4-ジオン
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
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
Molecular formula： C20H27NO5
Molecular formula furigana： C20-H27-N-O5
Molecular weight： 361.438
InChI：
InChI=1S/C20H27NO5/c1-5-9-17-20(4,25-13-15-10-7-6-8-11-15)18(23)21(19(24)26-17)16(12-22)14(2)3/h5-11,14,16-17,22H,12-13H2,1-4H3/t16-,17+,20+/m1/s1
InChI key：
RQPLYKFEUVAYFP-UWVAXJGDSA-N
SMILES：
CC=C[C@@H]1OC(=O)N([C@H](CO)C(C)C)C(=O)[C@@]1(C)OCc1ccccc1
Systematic name (3)：
- (5S)-3-[(S)-1-(ヒドロキシメチル)-2-メチルプロピル]-5β-(ベンジルオキシ)-5-メチル-6α-(1-プロペニル)テトラヒドロ-2H-1,3-オキサジン-2,4-ジオン
- (5S,6S)-5-(ベンジルオキシ)-3-[(2S)-1-ヒドロキシ-3-メチルブタン-2-イル]-5-メチル-6-(プロパ-1-エン-1-イル)-1,3-オキサジナン-2,4-ジオン
- (5S,6S)-5-(benzyloxy)-3-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methyl-6-(prop-1-en-1-yl)-1,3-oxazinane-2,4-dione
- (5S)-3-[(S)-1-(Hydroxymethyl)-2-methylpropyl]-5β-(benzyloxy)-5-methyl-6α-(1-propenyl)tetrahydro-2H-1,3-oxazine-2,4-dione
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