Chem
J-GLOBAL ID：200907018186209253   Nikkaji number：J34.243B

Glaucarubolone

グラウカルボロン
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： C20H26O8
Molecular formula furigana： C20-H26-O8
Molecular weight： 394.420
InChI： InChI=1S/C20H26O8/c1-7-4-10(21)15(24)18(3)9(7)5-11-19-6-27-20(26,17(18)19)14(23)8(2)12(19)13(22)16(25)28-11/h4,8-9,11-15,17,22-24,26H,5-6H2,1-3H3/t8-,9+,11-,12-,13-,14-,15-,17-,18-,19+,20+/m1/s1
InChI key： FJHVIRYYVWNHSM-FOSMHHDRSA-N
SMILES： C[C@H]1[C@@H](O)[C@]2(O)OC[C@]34[C@H]2[C@@]2(C)[C@H](O)C(=O)C=C(C)[C@@H]2C[C@H]3OC(=O)[C@H](O)[C@@H]14
Systematic name  (4)：
  • 11β,20-エポキシ-1β,11,12α,15β-テトラヒドロキシピクラサ-3-エン-2,16-ジオン
  • (1R)-1,2α,4β,11β-テトラヒドロキシ-3α,8,11aβ-トリメチル-1,2,3,3aβ,4,7,7aα,11,11a,11bα-デカヒドロ-5H-1β,11cβ-(エポキシメタノ)フェナントロ[10,1-bc]ピラン-5,10(6aβH)-ジオン
  • (1S,4R,5R,6R,7S,8R,11R,13S,17S,18S,19R)-4,5,8,17-テトラヒドロキシ-6,14,18-トリメチル-3,10-ジオキサペンタシクロ[9.8.0.01,7.04,19.013,18]ノナデカ-14-エン-9,16-ジオン
  • (1S,4R,5R,6R,7S,8R,11R,13S,17S,18S,19R)-4,5,8,17-tetrahydroxy-6,14,18-trimethyl-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-ene-9,16-dione
Other name (6)：
  • グラウカルボロン
  • Glaucarubolone
  • 11β,20-Epoxy-1β,11,12α,15β-tetrahydroxypicras-3-ene-2,16-dione
  • (1R)-1,2α,4β,11β-Tetrahydroxy-3α,8,11aβ-trimethyl-1,2,3,3aβ,4,7,7aα,11,11a,11bα-decahydro-5H-1β,11cβ-(epoxymethano)phenanthro[10,1-bc]pyran-5,10(6aβH)-dione
  • (-)-グラウカルボロン
Show all
CAS registry number： 1990-01-8
KEGG COMPOUND： C08764
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