Chem
J-GLOBAL ID:200907099813419854
Nikkaji number:J737.672C
(3R,4S,5R,7S,8S,9S)-5,7-Dimethyl-6-oxo-3,9:4,8-diepoxy-1,2-dioxonane-4-methanol acetate
(3R,4S,5R,7S,8S,9S)-5,7-ジメチル-6-オキソ-3,9:4,8-ジエポキシ-1,2-ジオキソナン-4-メタノールアセタート
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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:
C12 H16 O7
Molecular formula furigana:
C12-H16-O7
Molecular weight:
272.253
InChI:
InChI=1S/C12H16O7/c1-5-8(14)6(2)12(4-15-7(3)13)11-16-10(18-19-11)9(5)17-12/h5-6,9-11H,4H2,1-3H3/t5-,6+,9+,10+,11?,12-/m1/s1
InChI key:
LXHLYXAQCLCXLH-JRLFYOKUSA-N
SMILES:
C[C@H]1[C@@H]2O[C@@](COC(=O)C)([C@H]3OO[C@@H]2O3)[C@@H](C)C1=O
Systematic name (3):
(3R,4S,5R,7S,8S,9S)-5,7-ジメチル-6-オキソ-3,9:4,8-ジエポキシ-1,2-ジオキソナン-4-メタノールアセタート
[(1S,2R,5S,6S,7S,9R)-7,9-ジメチル-8-オキソ-3,4,10,11-テトラオキサトリシクロ[4.3.1.12,5 ]ウンデカン-1-イル]メチル アセタート
[(1S,2R,5S,6S,7S,9R)-7,9-dimethyl-8-oxo-3,4,10,11-tetraoxatricyclo[4.3.1.12,5 ]undecan-1-yl]methyl acetate
Other name (1):
(3R,4S,5R,7S,8S,9S)-5,7-Dimethyl-6-oxo-3,9:4,8-diepoxy-1,2-dioxonane-4-methanol acetate
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