Chem
J-GLOBAL ID:200907015717887554
Nikkaji number:J2.263.414C
Acetic acid [(2S)-2α,5β-bis(4-methoxy-1,3-benzodioxole-6-yl)-4α-(hydroxymethyl)tetrahydrofuran]-3β-ylmethyl ester
酢酸[(2S)-2α,5β-ビス(4-メトキシ-1,3-ベンゾジオキソール-6-イル)-4α-(ヒドロキシメチル)テトラヒドロフラン]-3β-イルメチル
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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:
C24 H26 O10
Molecular formula furigana:
C24-H26-O10
Molecular weight:
474.462
InChI:
InChI=1S/C24H26O10/c1-12(26)29-9-16-15(8-25)21(13-4-17(27-2)23-19(6-13)30-10-32-23)34-22(16)14-5-18(28-3)24-20(7-14)31-11-33-24/h4-7,15-16,21-22,25H,8-11H2,1-3H3/t15-,16-,21+,22+/m0/s1
InChI key:
YPQDTAINIDFHAR-RZTYQLBFSA-N
SMILES:
COc1cc(cc2OCOc12)[C@H]1O[C@@H]([C@@H](COC(=O)C)[C@@H]1CO)c1cc2OCOc2c(OC)c1
Systematic name (3):
酢酸[(2S)-2α,5β-ビス(4-メトキシ-1,3-ベンゾジオキソール-6-イル)-4α-(ヒドロキシメチル)テトラヒドロフラン]-3β-イルメチル
[(2S,3R,4R,5S)-4-(ヒドロキシメチル)-2,5-ビス(7-メトキシ-2H-1,3-ベンゾジオキソール-5-イル)オキソラン-3-イル]メチル アセタート
[(2S,3R,4R,5S)-4-(hydroxymethyl)-2,5-bis(7-methoxy-2H-1,3-benzodioxol-5-yl)oxolan-3-yl]methyl acetate
Other name (1):
Acetic acid [(2S)-2α,5β-bis(4-methoxy-1,3-benzodioxole-6-yl)-4α-(hydroxymethyl)tetrahydrofuran]-3β-ylmethyl ester
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