Chem
J-GLOBAL ID：200907054126535867
Nikkaji number：J1.879.253B
(2S)-1-(Benzyloxy)-7-[(2S)-3α-(4-methoxybenzyloxymethyl)oxirane-2β-yl]-5-heptene-2-ol
(2S)-1-(ベンジルオキシ)-7-[(2S)-3α-(4-メトキシベンジルオキシメチル)オキシラン-2β-イル]-5-ヘプテン-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： C25H32O5
Molecular formula furigana： C25-H32-O5
Molecular weight： 412.526
InChI：
InChI=1S/C25H32O5/c1-27-23-14-12-21(13-15-23)17-29-19-25-24(30-25)11-7-3-6-10-22(26)18-28-16-20-8-4-2-5-9-20/h2-5,7-9,12-15,22,24-26H,6,10-11,16-19H2,1H3/t22-,24-,25-/m0/s1
InChI key：
VBQNXDBOWOIOCF-HVCNVCAESA-N
SMILES：
COc1ccc(COC[C@@H]2O[C@H]2CC=CCC[C@H](O)COCc2ccccc2)cc1
Systematic name (3)：
- (2S)-1-(ベンジルオキシ)-7-[(2S)-3α-(4-メトキシベンジルオキシメチル)オキシラン-2β-イル]-5-ヘプテン-2-オール
- (2S)-1-(ベンジルオキシ)-7-[(2S,3S)-3-{[(4-メトキシフェニル)メトキシ]メチル}オキシラン-2-イル]ヘプタ-5-エン-2-オール
- (2S)-1-(benzyloxy)-7-[(2S,3S)-3-{[(4-methoxyphenyl)methoxy]methyl}oxiran-2-yl]hept-5-en-2-ol
- (2S)-1-(Benzyloxy)-7-[(2S)-3α-(4-methoxybenzyloxymethyl)oxirane-2β-yl]-5-heptene-2-ol
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