Chem
J-GLOBAL ID：200907094152276030
Nikkaji number：J1.282.814D
1-[(1S)-2,2-Dimethyl-3α-(1-propynyl)cyclopropane-1α-yl]-3-methyl-4-[2-(1,3-dioxolane-2-yl)-1-cyclopentenyl]-3-butene-2-ol
1-[(1S)-2,2-ジメチル-3α-(1-プロピニル)シクロプロパン-1α-イル]-3-メチル-4-[2-(1,3-ジオキソラン-2-イル)-1-シクロペンテニル]-3-ブテン-2-オール
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： C21H30O3
Molecular formula furigana： C21-H30-O3
Molecular weight： 330.468
InChI：
InChI=1S/C21H30O3/c1-5-7-17-18(21(17,3)4)13-19(22)14(2)12-15-8-6-9-16(15)20-23-10-11-24-20/h12,17-20,22H,6,8-11,13H2,1-4H3/t17-,18+,19?/m1/s1
InChI key：
AWLFNFHUPSLGHE-YTYFACEESA-N
SMILES：
CC#C[C@@H]1[C@H](CC(O)C(=CC2=C(CCC2)C2OCCO2)C)C1(C)C
Systematic name (3)：
- 1-[(1S)-2,2-ジメチル-3α-(1-プロピニル)シクロプロパン-1α-イル]-3-メチル-4-[2-(1,3-ジオキソラン-2-イル)-1-シクロペンテニル]-3-ブテン-2-オール
- 1-[(1S,3R)-2,2-ジメチル-3-(プロパ-1-イン-1-イル)シクロプロピル]-4-[2-(1,3-ジオキソラン-2-イル)シクロペンタ-1-エン-1-イル]-3-メチルブタ-3-エン-2-オール
- 1-[(1S,3R)-2,2-dimethyl-3-(prop-1-yn-1-yl)cyclopropyl]-4-[2-(1,3-dioxolan-2-yl)cyclopent-1-en-1-yl]-3-methylbut-3-en-2-ol
- 1-[(1S)-2,2-Dimethyl-3α-(1-propynyl)cyclopropane-1α-yl]-3-methyl-4-[2-(1,3-dioxolane-2-yl)-1-cyclopentenyl]-3-butene-2-ol
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