Chem
J-GLOBAL ID：201507068682952785   Nikkaji number：J3.342.496E

(3aS,9R,9aS,9bS)-2-Oxo-3-methylene-6,9-dimethyl-2,3,3a,4,5,7,8,9,9a,9b-decahydroazuleno[4,5-b]furan-9-ol 2-bromoacetate

(3aS,9R,9aS,9bS)-2-オキソ-3-メチレン-6,9-ジメチル-2,3,3a,4,5,7,8,9,9a,9b-デカヒドロアズレノ[4,5-b]フラン-9-オール2-ブロモアセタート
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： C17H21BrO4
Molecular formula furigana： C17-H21-BR-O4
Molecular weight： 369.255
InChI： InChI=1S/C17H21BrO4/c1-9-4-5-12-10(2)16(20)21-15(12)14-11(9)6-7-17(14,3)22-13(19)8-18/h12,14-15H,2,4-8H2,1,3H3/t12-,14-,15-,17+/m0/s1
InChI key： JUYSEWAOBKDLIQ-NZUILWFCSA-N
SMILES： CC1=C2CC[C@@](C)(OC(=O)CBr)[C@@H]2[C@H]2OC(=O)C(=C)[C@@H]2CC1
Systematic name  (3)：
  • (3aS,9R,9aS,9bS)-2-オキソ-3-メチレン-6,9-ジメチル-2,3,3a,4,5,7,8,9,9a,9b-デカヒドロアズレノ[4,5-b]フラン-9-オール2-ブロモアセタート
  • (3aS,9R,9aS,9bS)-6,9-ジメチル-3-メチリデン-2-オキソ-2H,3H,3aH,4H,5H,7H,8H,9H,9aH,9bH-アズレノ[4,5-b]フラン-9-イル 2-ブロモアセタート
  • (3aS,9R,9aS,9bS)-6,9-dimethyl-3-methylidene-2-oxo-2H,3H,3aH,4H,5H,7H,8H,9H,9aH,9bH-azuleno[4,5-b]furan-9-yl 2-bromoacetate
Other name (1)：
  • (3aS,9R,9aS,9bS)-2-Oxo-3-methylene-6,9-dimethyl-2,3,3a,4,5,7,8,9,9a,9b-decahydroazuleno[4,5-b]furan-9-ol 2-bromoacetate
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