Chem
J-GLOBAL ID：200907003910963847   Nikkaji number：J1.851.803A

(1S)-1β,4aβ-Dihydroxy-4,4,6aα,12bα-tetramethyl-9-(3,4-dimethoxyphenyl)-1,2,3,4a,5,6,6a,12b-octahydro-4H,11H-naphtho[2,1-b]pyrano[3,4-e]pyran-11-one

(5aR,7aR,11S,11aS)-3-(3,4-ジメトキシフェニル)-7a,11-ジヒドロキシ-5a,8,8,11a-テトラメチル-1,5a,6,7,7a,8,9,10,11,11a-デカヒドロ-2,5-ジオキサテトラフェン-1-オン
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： C28H34O7
Molecular formula furigana： C28-H34-O7
Molecular weight： 482.573
InChI： InChI=1S/C28H34O7/c1-25(2)10-9-23(29)27(4)22-14-17-20(35-26(22,3)11-12-28(25,27)31)15-19(34-24(17)30)16-7-8-18(32-5)21(13-16)33-6/h7-8,13-15,23,29,31H,9-12H2,1-6H3/t23-,26+,27-,28+/m0/s1
InChI key： JGDWZMNIOMERSY-NXKWUFEUSA-N
SMILES： COc1ccc(cc1OC)c1cc2O[C@]3(C)CC[C@@]4(O)C(C)(C)CC[C@H](O)[C@]4(C)C3=Cc2c(=O)o1
Systematic name  (4)：
  • (4aR)-1β,4aβ-ジヒドロキシ-4,4,6aα,12bα-テトラメチル-9-(3,4-ジメトキシフェニル)-1,2,3,4a,5,6,6a,12b-オクタヒドロ-4H,11H-ナフト[2,1-b]ピラノ[3,4-e]ピラン-11-オン
  • (1S)-1β,4aβ-ジヒドロキシ-4,4,6aα,12bα-テトラメチル-9-(3,4-ジメトキシフェニル)-1,2,3,4a,5,6,6a,12b-オクタヒドロ-4H,11H-ナフト[2,1-b]ピラノ[3,4-e]ピラン-11-オン
  • (5aR,7aR,11S,11aS)-3-(3,4-ジメトキシフェニル)-7a,11-ジヒドロキシ-5a,8,8,11a-テトラメチル-1,5a,6,7,7a,8,9,10,11,11a-デカヒドロ-2,5-ジオキサテトラフェン-1-オン
  • (5aR,7aR,11S,11aS)-3-(3,4-dimethoxyphenyl)-7a,11-dihydroxy-5a,8,8,11a-tetramethyl-1,5a,6,7,7a,8,9,10,11,11a-decahydro-2,5-dioxatetraphen-1-one
Other name (2)：
  • (4aR)-1β,4aβ-Dihydroxy-4,4,6aα,12bα-tetramethyl-9-(3,4-dimethoxyphenyl)-1,2,3,4a,5,6,6a,12b-octahydro-4H,11H-naphtho[2,1-b]pyrano[3,4-e]pyran-11-one
  • (1S)-1β,4aβ-Dihydroxy-4,4,6aα,12bα-tetramethyl-9-(3,4-dimethoxyphenyl)-1,2,3,4a,5,6,6a,12b-octahydro-4H,11H-naphtho[2,1-b]pyrano[3,4-e]pyran-11-one
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