Chem
J-GLOBAL ID:200907048369223200   Nikkaji number:J1.663.010A

(7R)-5β-(Hydroxymethyl)-7-cyclopropyl-7-(1,3-dibromopropyl)-6-oxabicyclo[3.2.1]octane-1-carboxylic acid methyl ester

(7R)-5β-(ヒドロキシメチル)-7-シクロプロピル-7-(1,3-ジブロモプロピル)-6-オキサビシクロ[3.2.1]オクタン-1-カルボン酸メチル
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: C16H24Br2O4
Molecular formula furigana: C16-H24-BR2-O4
Molecular weight: 440.172
InChI: InChI=1S/C16H24Br2O4/c1-21-13(20)15-7-2-6-14(9-15,10-19)22-16(15,11-3-4-11)12(18)5-8-17/h11-12,19H,2-10H2,1H3/t12?,14-,15?,16+/m1/s1
InChI key: BEYLVASHLUMMSO-UHDQLFAASA-N
SMILES: COC(=O)C12C[C@@](CO)(CCC1)O[C@]2(C(Br)CCBr)C1CC1
Systematic name  (3):
  • (7R)-5β-(ヒドロキシメチル)-7-シクロプロピル-7-(1,3-ジブロモプロピル)-6-オキサビシクロ[3.2.1]オクタン-1-カルボン酸メチル
  • メチル (5R,7R)-7-シクロプロピル-7-(1,3-ジブロモプロピル)-5-(ヒドロキシメチル)-6-オキサビシクロ[3.2.1]オクタン-1-カルボキシラート
  • methyl (5R,7R)-7-cyclopropyl-7-(1,3-dibromopropyl)-5-(hydroxymethyl)-6-oxabicyclo[3.2.1]octane-1-carboxylate
Other name (1):
  • (7R)-5β-(Hydroxymethyl)-7-cyclopropyl-7-(1,3-dibromopropyl)-6-oxabicyclo[3.2.1]octane-1-carboxylic acid methyl ester
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