Chem
J-GLOBAL ID：200907034666307315   Nikkaji number：J2.085.767F

(5β)-1β-(Hydroxymethyl)-2β-(allyloxy)-4β-(4-methoxybenzyloxy)-6-oxabicyclo[3.1.0]hexane-3α-ol

(5β)-1β-(ヒドロキシメチル)-2β-(アリルオキシ)-4β-(4-メトキシベンジルオキシ)-6-オキサビシクロ[3.1.0]ヘキサン-3α-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： C17H22O6
Molecular formula furigana： C17-H22-O6
Molecular weight： 322.357
InChI： InChI=1S/C17H22O6/c1-3-8-21-15-13(19)14(16-17(15,10-18)23-16)22-9-11-4-6-12(20-2)7-5-11/h3-7,13-16,18-19H,1,8-10H2,2H3/t13-,14-,15+,16+,17+/m1/s1
InChI key： WOMRRBMYSJDKQP-NRKLIOEPSA-N
SMILES： COc1ccc(CO[C@H]2[C@@H]3O[C@@]3(CO)[C@@H](OCC=C)[C@@H]2O)cc1
Systematic name  (3)：
  • (5β)-1β-(ヒドロキシメチル)-2β-(アリルオキシ)-4β-(4-メトキシベンジルオキシ)-6-オキサビシクロ[3.1.0]ヘキサン-3α-オール
  • (1R,2S,3R,4R,5S)-1-(ヒドロキシメチル)-4-[(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)-6-オキサビシクロ[3.1.0]ヘキサン-3-オール
  • (1R,2S,3R,4R,5S)-1-(hydroxymethyl)-4-[(4-methoxyphenyl)methoxy]-2-(prop-2-en-1-yloxy)-6-oxabicyclo[3.1.0]hexan-3-ol
Other name (1)：
  • (5β)-1β-(Hydroxymethyl)-2β-(allyloxy)-4β-(4-methoxybenzyloxy)-6-oxabicyclo[3.1.0]hexane-3α-ol
Thsaurus map：
Thesaurus Map

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