Chem
J-GLOBAL ID：200907024413968719   Nikkaji number：J1.815.467F

Epoxyquinol B

エポキシキノールB
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： C20H20O8
Molecular formula furigana： C20-H20-O8
Molecular weight： 388.372
InChI： InChI=1S/C20H20O8/c1-4-7-8-9(13(23)16-15(27-16)12(8)22)19(26-4)20-6(3-25-5(2)10(7)20)11(21)14-17(28-14)18(20)24/h3-5,7,10-11,13-17,19,21,23H,1-2H3/t4-,5+,7+,10+,11-,13-,14+,15-,16+,17+,19-,20+/m0/s1
InChI key： HJZHVRIBNUVKQX-YUSKPSTASA-N
SMILES： C[C@H]1OC=C2[C@H](O)[C@H]3O[C@H]3C(=O)[C@]32[C@H]2O[C@@H](C)[C@@H]([C@@H]13)C1=C2[C@H](O)[C@H]2O[C@H]2C1=O
Systematic name  (3)：
  • (2R,13aR,15S)-4β,12β-ジヒドロキシ-7α,15-ジメチル-2α,3α:10α,11α-ジエポキシ-13α,8α-(エポキシメタノ)-1,2,3,4,7,7aβ,8,9,10,11,12,13-ドデカヒドロ-6-オキサ-6H-ベンゾ[d]アントラセン-1,9-ジオン
  • (1S,2R,4R,6R,7S,11R,12R,13S,16R,18R,19S,22S)-7,19-ジヒドロキシ-11,22-ジメチル-5,10,17,21-テトラオキサヘプタシクロ[11.7.2.02,8.02,12.04,6.014,20.016,18]ドコサ-8,14(20)-ジエン-3,15-ジオン
  • (1S,2R,4R,6R,7S,11R,12R,13S,16R,18R,19S,22S)-7,19-dihydroxy-11,22-dimethyl-5,10,17,21-tetraoxaheptacyclo[11.7.2.02,8.02,12.04,6.014,20.016,18]docosa-8,14(20)-diene-3,15-dione
Other name (3)：
  • (2R,13aR,15S)-4β,12β-Dihydroxy-7α,15-dimethyl-2α,3α:10α,11α-diepoxy-13α,8α-(epoxymethano)-1,2,3,4,7,7aβ,8,9,10,11,12,13-dodecahydro-6-oxa-6H-benzo[d]anthracene-1,9-dione
  • エポキシキノールB
  • Epoxyquinol B
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