Chem
J-GLOBAL ID：200907056219512312   Nikkaji number：J764.453A

Acetic acid [(1R,4aβ)-5β-[[(3aα,6aα)-5α-ethoxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan]-2α-yl]-5,6α-dimethyl-9-ethoxy-4,4a,5,6,7,8-hexahydro-3H-3α,8aα-(epoxymethano)spiro[naphthalene-1(2H),2′-oxirane]]-8α-yl ester

(1'R,2R,2'S,4'R,5'S,6'R,8'R)-5'-[(2S,3aS,5R,6aR)-5-エトキシ-ヘキサヒドロフロ[2,3-b]フラン-2-イル]-11'-エトキシ-4',5'-ジメチル-12'-オキサスピロ[オキシラン-2,10'-トリシクロ[6.2.2.01,6]ドデカン]-2'-イル 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： C26H40O8
Molecular formula furigana： C26-H40-O8
Molecular weight： 480.598
InChI： InChI=1S/C26H40O8/c1-6-28-21-10-16-9-19(33-22(16)34-21)24(5)14(3)8-20(31-15(4)27)26-18(24)11-17(12-25(26)13-30-25)32-23(26)29-7-2/h14,16-23H,6-13H2,1-5H3/t14-,16+,17-,18-,19+,20+,21-,22-,23?,24+,25+,26+/m1/s1
InChI key： SFPHFTYKCHLKGP-GUMMUXEWSA-N
SMILES： CCO[C@H]1C[C@@H]2C[C@H](O[C@@H]2O1)[C@@]1(C)[C@H](C)C[C@H](OC(=O)C)[C@]23C(OCC)O[C@H](C[C@H]12)C[C@@]13CO1
Systematic name  (3)：
  • 酢酸[(1R,4aβ)-5β-[[(3aα,6aα)-5α-エトキシ-2,3,3a,4,5,6a-ヘキサヒドロフロ[2,3-b]フラン]-2α-イル]-5,6α-ジメチル-9-エトキシ-4,4a,5,6,7,8-ヘキサヒドロ-3H-3α,8aα-(エポキシメタノ)スピロ[ナフタレン-1(2H),2′-オキシラン]]-8α-イル
  • (1'R,2R,2'S,4'R,5'S,6'R,8'R)-5'-[(2S,3aS,5R,6aR)-5-エトキシ-ヘキサヒドロフロ[2,3-b]フラン-2-イル]-11'-エトキシ-4',5'-ジメチル-12'-オキサスピロ[オキシラン-2,10'-トリシクロ[6.2.2.01,6]ドデカン]-2'-イル アセタート
  • (1'R,2R,2'S,4'R,5'S,6'R,8'R)-5'-[(2S,3aS,5R,6aR)-5-ethoxy-hexahydrofuro[2,3-b]furan-2-yl]-11'-ethoxy-4',5'-dimethyl-12'-oxaspiro[oxirane-2,10'-tricyclo[6.2.2.01,6]dodecan]-2'-yl acetate
Other name (1)：
  • Acetic acid [(1R,4aβ)-5β-[[(3aα,6aα)-5α-ethoxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan]-2α-yl]-5,6α-dimethyl-9-ethoxy-4,4a,5,6,7,8-hexahydro-3H-3α,8aα-(epoxymethano)spiro[naphthalene-1(2H),2′-oxirane]]-8α-yl ester
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