Chem
J-GLOBAL ID：200907000399718856   Nikkaji number：J238.613E

1,3,3aβ,4a,5,8,10,10aβ,11a,12-Decahydro-4aβ,7,11aβ,14-tetrahydroxy-1α,3β,8α,10β-tetramethyl-6H,13H-2,4,9,11-tetraoxadibenzo[bc,kl]coronene-6,13-dione

1,3,3aβ,4a,5,8,10,10aβ,11a,12-デカヒドロ-4aβ,7,11aβ,14-テトラヒドロキシ-1α,3β,8α,10β-テトラメチル-6H,13H-2,4,9,11-テトラオキサジベンゾ[bc,kl]コロネン-6,13-ジオン
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： C30H26O10
Molecular formula furigana： C30-H26-O10
Molecular weight： 546.528
InChI： InChI=1S/C30H26O10/c1-7-13-21-19-17-15(25(13)33)11(31)5-30(36)24(17)20-18-16(26(34)14-8(2)38-10(4)28(40-30)22(14)20)12(32)6-29(35,23(18)19)39-27(21)9(3)37-7/h7-10,27-28,33-36H,5-6H2,1-4H3/t7-,8-,9-,10-,27-,28-,29+,30+/m0/s1
InChI key： HNUPXDLGAHSVEQ-OGJBRUNOSA-N
SMILES： C[C@@H]1O[C@@H](C)c2c(O)c3C(=O)C[C@@]4(O)O[C@H]5[C@H](C)O[C@@H](C)c6c(O)c7C(=O)C[C@@]8(O)O[C@@H]1c2c1c8c7c(c56)c4c31
Systematic name  (3)：
  • 1,3,3aβ,4a,5,8,10,10aβ,11a,12-デカヒドロ-4aβ,7,11aβ,14-テトラヒドロキシ-1α,3β,8α,10β-テトラメチル-6H,13H-2,4,9,11-テトラオキサジベンゾ[bc,kl]コロネン-6,13-ジオン
  • (7S,9S,10R,12R,18S,20S,21R,23R)-12,16,23,30-テトラヒドロキシ-7,9,18,20-テトラメチル-8,11,19,22-テトラオキサノナシクロ[15.11.1.16,26.02,15.03,12.04,27.05,10.021,29.023,28]トリアコンタ-1(28),2,4,6(30),15,17(29),26-ヘプタエン-14,25-ジオン
  • (7S,9S,10R,12R,18S,20S,21R,23R)-12,16,23,30-tetrahydroxy-7,9,18,20-tetramethyl-8,11,19,22-tetraoxanonacyclo[15.11.1.16,26.02,15.03,12.04,27.05,10.021,29.023,28]triaconta-1(28),2,4,6(30),15,17(29),26-heptaene-14,25-dione
Other name (1)：
  • 1,3,3aβ,4a,5,8,10,10aβ,11a,12-Decahydro-4aβ,7,11aβ,14-tetrahydroxy-1α,3β,8α,10β-tetramethyl-6H,13H-2,4,9,11-tetraoxadibenzo[bc,kl]coronene-6,13-dione
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