Chem
J-GLOBAL ID：200907054712285055   Nikkaji number：J1.180.350D

(3S)-8-[(4S)-2,2-Dimethyl-5α-heptyl-1,3-dioxolane-4β-yl]-1-octene-4,6-diyne-3-ol

(3S)-8-[(4S)-2,2-ジメチル-5α-ヘプチル-1,3-ジオキソラン-4β-イル]-1-オクテン-4,6-ジイン-3-オール
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： C20H30O3
Molecular formula furigana： C20-H30-O3
Molecular weight： 318.457
InChI： InChI=1S/C20H30O3/c1-5-7-8-9-12-15-18-19(23-20(3,4)22-18)16-13-10-11-14-17(21)6-2/h6,17-19,21H,2,5,7-9,12,15-16H2,1,3-4H3/t17-,18-,19-/m0/s1
InChI key： JVJTWOPEMAGFNK-FHWLQOOXSA-N
SMILES： CCCCCCC[C@@H]1OC(C)(C)O[C@H]1CC#CC#C[C@@H](O)C=C
Systematic name  (4)：
  • (3S)-8-[(4S,5S)-2,2-ジメチル-5-ヘプチル-1,3-ジオキソラン-4-イル]-1-オクテン-4,6-ジイン-3-オール
  • (3S)-8-[(4S)-2,2-ジメチル-5α-ヘプチル-1,3-ジオキソラン-4β-イル]-1-オクテン-4,6-ジイン-3-オール
  • (3S)-8-[(4S,5S)-5-ヘプチル-2,2-ジメチル-1,3-ジオキソラン-4-イル]オクタ-1-エン-4,6-ジイン-3-オール
  • (3S)-8-[(4S,5S)-5-heptyl-2,2-dimethyl-1,3-dioxolan-4-yl]oct-1-en-4,6-diyn-3-ol
Other name (2)：
  • (3S)-8-[(4S,5S)-2,2-Dimethyl-5-heptyl-1,3-dioxolane-4-yl]-1-octene-4,6-diyne-3-ol
  • (3S)-8-[(4S)-2,2-Dimethyl-5α-heptyl-1,3-dioxolane-4β-yl]-1-octene-4,6-diyne-3-ol
Thsaurus map：
Thesaurus Map

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