Chem
J-GLOBAL ID：200907070828179177
Nikkaji number：J2.077.032E
(5R)-5β-[[(E)-2-Methyl-2-butenoyl]oxy]-6α-[2-[(4S)-2,2,5α-trimethyl-1,3-dioxolane-4β-yl]ethyl]-5,6-dihydro-2H-pyran-2-one
(5R)-5β-[[(E)-2-メチル-2-ブテノイル]オキシ]-6α-[2-[(4S)-2,2,5α-トリメチル-1,3-ジオキソラン-4β-イル]エチル]-5,6-ジヒドロ-2H-ピラン-2-オン
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
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
Molecular formula： C18H26O6
Molecular formula furigana： C18-H26-O6
Molecular weight： 338.400
InChI：
InChI=1S/C18H26O6/c1-6-11(2)17(20)22-15-9-10-16(19)21-14(15)8-7-13-12(3)23-18(4,5)24-13/h6,9-10,12-15H,7-8H2,1-5H3/b11-6+/t12-,13-,14-,15+/m0/s1
InChI key：
VXSINWPDHIPMHJ-LDZGBVGCSA-N
SMILES：
C/C=C(\C)/C(=O)O[C@@H]1C=CC(=O)O[C@H]1CC[C@@H]1OC(C)(C)O[C@H]1C
Systematic name (3)：
- (5R)-5β-[[(E)-2-メチル-2-ブテノイル]オキシ]-6α-[2-[(4S)-2,2,5α-トリメチル-1,3-ジオキソラン-4β-イル]エチル]-5,6-ジヒドロ-2H-ピラン-2-オン
- (2S,3R)-6-オキソ-2-{2-[(4S,5S)-2,2,5-トリメチル-1,3-ジオキソラン-4-イル]エチル}-3,6-ジヒドロ-2H-ピラン-3-イル (2E)-2-メチルブタ-2-エノアート
- (2S,3R)-6-oxo-2-{2-[(4S,5S)-2,2,5-trimethyl-1,3-dioxolan-4-yl]ethyl}-3,6-dihydro-2H-pyran-3-yl (2E)-2-methylbut-2-enoate
- (5R)-5β-[[(E)-2-Methyl-2-butenoyl]oxy]-6α-[2-[(4S)-2,2,5α-trimethyl-1,3-dioxolane-4β-yl]ethyl]-5,6-dihydro-2H-pyran-2-one
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