Chem
J-GLOBAL ID：200907078859933466   Nikkaji number：J2.098.671I

(3R)-3α-[3,4-Di(2H3)methoxy-5-hydroxybenzyl]-4β-(1,3-benzodioxole-5-ylmethyl)tetrahydrofuran-2-one

(3R)-3α-[3,4-ジ(2H3)メトキシ-5-ヒドロキシベンジル]-4β-(1,3-ベンゾジオキソール-5-イルメチル)テトラヒドロフラン-2-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： C21H16[2H]6O7
Molecular formula furigana： C21-H22-O7
Molecular weight： 392.437
InChI： InChI=1S/C21H22O7/c1-24-19-9-13(7-16(22)20(19)25-2)6-15-14(10-26-21(15)23)5-12-3-4-17-18(8-12)28-11-27-17/h3-4,7-9,14-15,22H,5-6,10-11H2,1-2H3/t14-,15+/m0/s1/i1D3,2D3
InChI key： PFCOJAPJHVVASV-INZUWZBFSA-N
SMILES： C([2H])([2H])([2H])Oc1cc(C[C@@H]2[C@@H](Cc3ccc4OCOc4c3)COC2=O)cc(O)c1OC([2H])([2H])[2H]
Systematic name  (3)：
  • (3R)-3α-[3,4-ジ(2H3)メトキシ-5-ヒドロキシベンジル]-4β-(1,3-ベンゾジオキソール-5-イルメチル)テトラヒドロフラン-2-オン
  • (3R,4R)-4-[(2H-1,3-ベンゾジオキソール-5-イル)メチル]-3-{[3-ヒドロキシ-4,5-ジ(2H3)メトキシフェニル]メチル}オキソラン-2-オン
  • (3R,4R)-4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{[3-hydroxy-4,5-di(2H3)methoxyphenyl]methyl}oxolan-2-one
Other name (1)：
  • (3R)-3α-[3,4-Di(2H3)methoxy-5-hydroxybenzyl]-4β-(1,3-benzodioxole-5-ylmethyl)tetrahydrofuran-2-one
Thsaurus map：
Thesaurus Map

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