Chem
J-GLOBAL ID:200907068556189491
Nikkaji number:J1.608.750E
4,5-Epoxy-2-methyloctane-1,3,6,8-tetrol 1,8-bisbenzoate
4,5-エポキシ-2-メチルオクタン-1,3,6,8-テトラオール1,8-ビスベンゾアート
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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:
C23 H26 O7
Molecular formula furigana:
C23-H26-O7
Molecular weight:
414.454
InChI:
InChI=1S/C23H26O7/c1-15(14-29-23(27)17-10-6-3-7-11-17)19(25)21-20(30-21)18(24)12-13-28-22(26)16-8-4-2-5-9-16/h2-11,15,18-21,24-25H,12-14H2,1H3
InChI key:
WYGMYORXXBPTTP-UHFFFAOYSA-N
SMILES:
CC(COC(=O)c1ccccc1)C(O)C1OC1C(O)CCOC(=O)c1ccccc1
Systematic name (3):
4,5-エポキシ-2-メチルオクタン-1,3,6,8-テトラオール1,8-ビスベンゾアート
3-{3-[3-(ベンゾイルオキシ)-1-ヒドロキシプロピル]オキシラン-2-イル}-3-ヒドロキシ-2-メチルプロピル ベンゾアート
3-{3-[3-(benzoyloxy)-1-hydroxypropyl]oxiran-2-yl}-3-hydroxy-2-methylpropyl benzoate
Other name (1):
4,5-Epoxy-2-methyloctane-1,3,6,8-tetrol 1,8-bisbenzoate
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