Chem
J-GLOBAL ID：200907002810244910   Nikkaji number：J2.516.636A

(2S,3S)-2-(3-Methoxybenzyl)-3-[(2S)-1,4-dioxaspiro[4.5]decane-2-yl]-4-pentene-1-ol

(2S,3S)-2-(3-メトキシベンジル)-3-[(2S)-1,4-ジオキサスピロ[4.5]デカン-2-イル]-4-ペンテン-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： C21H30O4
Molecular formula furigana： C21-H30-O4
Molecular weight： 346.467
InChI： InChI=1S/C21H30O4/c1-3-19(20-15-24-21(25-20)10-5-4-6-11-21)17(14-22)12-16-8-7-9-18(13-16)23-2/h3,7-9,13,17,19-20,22H,1,4-6,10-12,14-15H2,2H3/t17-,19+,20-/m1/s1
InChI key： GAESNEHXIYKWKY-YZGWKJHDSA-N
SMILES： COc1cccc(C[C@H](CO)[C@H](C=C)[C@H]2COC3(CCCCC3)O2)c1
Systematic name  (3)：
  • (2S,3S)-2-(3-メトキシベンジル)-3-[(2S)-1,4-ジオキサスピロ[4.5]デカン-2-イル]-4-ペンテン-1-オール
  • (2S,3S)-3-[(2S)-1,4-ジオキサスピロ[4.5]デカン-2-イル]-2-[(3-メトキシフェニル)メチル]ペンタ-4-エン-1-オール
  • (2S,3S)-3-[(2S)-1,4-dioxaspiro[4.5]decan-2-yl]-2-[(3-methoxyphenyl)methyl]pent-4-en-1-ol
Other name (1)：
  • (2S,3S)-2-(3-Methoxybenzyl)-3-[(2S)-1,4-dioxaspiro[4.5]decane-2-yl]-4-pentene-1-ol
Thsaurus map：
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