Chem
J-GLOBAL ID：200907055887713005   Nikkaji number：J759.735E

Sesartemin

セサルテミン
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： C23H26O8
Molecular formula furigana： C23-H26-O8
Molecular weight： 430.453
InChI： InChI=1S/C23H26O8/c1-24-16-5-12(6-17(25-2)22(16)27-4)20-14-9-29-21(15(14)10-28-20)13-7-18(26-3)23-19(8-13)30-11-31-23/h5-8,14-15,20-21H,9-11H2,1-4H3/t14-,15-,20+,21+/m0/s1
InChI key： DHWUVPPRBIJJKS-VUEDXXQZSA-N
SMILES： COc1cc(cc2OCOc12)[C@H]1OC[C@H]2[C@@H]1CO[C@@H]2c1cc(OC)c(OC)c(OC)c1
Systematic name  (3)：
  • 4-メトキシ-6-[[(1S,3aβ,6aβ)-テトラヒドロ-4β-(3,4,5-トリメトキシフェニル)-1H,3H-フロ[3,4-c]フラン]-1β-イル]-1,3-ベンゾジオキソール
  • 6-[(1S,3aR,4S,6aR)-4-(3,4,5-トリメトキシフェニル)-ヘキサヒドロフロ[3,4-c]フラン-1-イル]-4-メトキシ-2H-1,3-ベンゾジオキソール
  • 6-[(1S,3aR,4S,6aR)-4-(3,4,5-trimethoxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]-4-methoxy-2H-1,3-benzodioxole
Other name (3)：
  • セサルテミン
  • Sesartemin
  • 4-Methoxy-6-[[(1S,3aβ,6aβ)-tetrahydro-4β-(3,4,5-trimethoxyphenyl)-1H,3H-furo[3,4-c]furan]-1β-yl]-1,3-benzodioxole
CAS registry number： 77394-27-5
KEGG COMPOUND： C10884
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