Chem
J-GLOBAL ID：200907047873517910   Nikkaji number：J2.298.434I

(2S,3S,4R)-2,4-Dimethyl-3-(4-methoxybenzyloxy)-5-heptyne-1-ol

(2S,3S,4R)-2,4-ジメチル-3-(4-メトキシベンジルオキシ)-5-ヘプチン-1-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： C17H24O3
Molecular formula furigana： C17-H24-O3
Molecular weight： 276.376
InChI： InChI=1S/C17H24O3/c1-5-6-13(2)17(14(3)11-18)20-12-15-7-9-16(19-4)10-8-15/h7-10,13-14,17-18H,11-12H2,1-4H3/t13-,14+,17+/m1/s1
InChI key： UNUZQINEKHMBSD-KEYYUXOJSA-N
SMILES： COc1ccc(CO[C@H]([C@@H](C)CO)[C@H](C)C#CC)cc1
Systematic name  (3)：
  • (2S,3S,4R)-2,4-ジメチル-3-(4-メトキシベンジルオキシ)-5-ヘプチン-1-オール
  • (2S,3S,4R)-3-[(4-メトキシフェニル)メトキシ]-2,4-ジメチルヘプタ-5-イン-1-オール
  • (2S,3S,4R)-3-[(4-methoxyphenyl)methoxy]-2,4-dimethylhept-5-yn-1-ol
Other name (1)：
  • (2S,3S,4R)-2,4-Dimethyl-3-(4-methoxybenzyloxy)-5-heptyne-1-ol
Thsaurus map：
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