Chem
J-GLOBAL ID：200907082479074557
Nikkaji number：J1.985.078A
(3S)-3α-(4-Methoxybenzyloxy)-4β-hydroxy-5α-(allyloxy)-1-cyclopentene-1-methanol
(3S)-3α-(4-メトキシベンジルオキシ)-4β-ヒドロキシ-5α-(アリルオキシ)-1-シクロペンテン-1-メタノール
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： C17H22O5
Molecular formula furigana： C17-H22-O5
Molecular weight： 306.358
InChI：
InChI=1S/C17H22O5/c1-3-8-21-17-13(10-18)9-15(16(17)19)22-11-12-4-6-14(20-2)7-5-12/h3-7,9,15-19H,1,8,10-11H2,2H3/t15-,16+,17+/m0/s1
InChI key：
MCQZAHYIHNNLSC-GVDBMIGSSA-N
SMILES：
COc1ccc(CO[C@H]2C=C(CO)[C@@H](OCC=C)[C@@H]2O)cc1
Systematic name (4)：
- (3S)-3α-(4-メトキシベンジルオキシ)-4β-ヒドロキシ-5α-(アリルオキシ)-1-シクロペンテン-1-メタノール
- (1R)-2α-(アリルオキシ)-3-(ヒドロキシメチル)-5α-(4-メトキシベンジルオキシ)-3-シクロペンテン-1β-オール
- (1R,2R,5S)-3-(ヒドロキシメチル)-5-[(4-メトキシフェニル)メトキシ]-2-(プロパ-2-エン-1-イルオキシ)シクロペンタ-3-エン-1-オール
- (1R,2R,5S)-3-(hydroxymethyl)-5-[(4-methoxyphenyl)methoxy]-2-(prop-2-en-1-yloxy)cyclopent-3-en-1-ol
- (3S)-3α-(4-Methoxybenzyloxy)-4β-hydroxy-5α-(allyloxy)-1-cyclopentene-1-methanol
- (1R)-2α-(Allyloxy)-3-(hydroxymethyl)-5α-(4-methoxybenzyloxy)-3-cyclopentene-1β-ol
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