Chem
J-GLOBAL ID:200907028228629750
Nikkaji number:J857.665C
8-[(4S,5S)-2,2-Dimethyl-5-heptyl-1,3-dioxolan-4-yl]-1-octene-4,6-diyn-3-ol
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
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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:
C20 H30 O3
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-MNNMKWMVSA-N
SMILES:
CCCCCCC[C@@H]1OC(C)(C)O[C@H]1CC#CC#CC(O)C=C
Systematic name (3):
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
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
8-[(4S,5S)-5-heptyl-2,2-dimethyl-1,3-dioxolan-4-yl]oct-1-en-4,6-diyn-3-ol
Other name (1):
8-[(4S,5S)-2,2-Dimethyl-5-heptyl-1,3-dioxolan-4-yl]-1-octene-4,6-diyn-3-ol
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