Chem
J-GLOBAL ID:200907089911746469   Nikkaji number:J467.027B

(3aα,8aα)-Tetrahydro-7-hydroxy-4α,7α-methano-2,2-dimethyl-1,3-dioxolo[4,5-c]oxepin-6(7H)-one

(3aβ,7aβ)-2,2-ジメチル-5,7α-ジヒドロキシヘキサヒドロ-1,3-ベンゾジオキソール-5α-カルボン酸5,7-ラクトン
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: C10H14O5
Molecular formula furigana: C10-H14-O5
Molecular weight: 214.217
InChI: InChI=1S/C10H14O5/c1-9(2)14-6-4-10(12)3-5(7(6)15-9)13-8(10)11/h5-7,12H,3-4H2,1-2H3/t5-,6+,7-,10-/m0/s1
InChI key: YRUDAAXXYUYEQL-XIVUIJJLSA-N
SMILES: CC1(C)O[C@@H]2C[C@@]3(O)C[C@H](OC3=O)[C@@H]2O1
Systematic name  (4):
  • (3aα,8aα)-テトラヒドロ-7-ヒドロキシ-4α,7α-メタノ-2,2-ジメチル-1,3-ジオキソロ[4,5-c]オキセピン-6(7H)-オン
  • (3aβ,7aβ)-2,2-ジメチル-5,7α-ジヒドロキシヘキサヒドロ-1,3-ベンゾジオキソール-5α-カルボン酸5,7-ラクトン
  • (1S,2R,6R,8R)-8-ヒドロキシ-4,4-ジメチル-3,5,10-トリオキサトリシクロ[6.2.1.02,6]ウンデカン-9-オン
  • (1S,2R,6R,8R)-8-hydroxy-4,4-dimethyl-3,5,10-trioxatricyclo[6.2.1.02,6]undecan-9-one
Other name (2):
  • (3aα,8aα)-Tetrahydro-7-hydroxy-4α,7α-methano-2,2-dimethyl-1,3-dioxolo[4,5-c]oxepin-6(7H)-one
  • (3aβ,7aβ)-2,2-Dimethyl-5,7α-dihydroxyhexahydro-1,3-benzodioxole-5α-carboxylic acid 5,7-lactone
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