Chem
J-GLOBAL ID：200907007507540095   Nikkaji number：J2.282.222E

α-Phenylglyoxylic acid (1S,4α)-1β-allyl-3α-(4-methoxybenzyloxy)-7,7-dimethylbicyclo[2.2.1]heptane-2α-yl ester

α-フェニルグリオキシル酸(1S,4α)-1β-アリル-3α-(4-メトキシベンジルオキシ)-7,7-ジメチルビシクロ[2.2.1]ヘプタン-2α-イル
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： C28H32O5
Molecular formula furigana： C28-H32-O5
Molecular weight： 448.559
InChI： InChI=1S/C28H32O5/c1-5-16-28-17-15-22(27(28,2)3)24(32-18-19-11-13-21(31-4)14-12-19)25(28)33-26(30)23(29)20-9-7-6-8-10-20/h5-14,22,24-25H,1,15-18H2,2-4H3/t22-,24-,25-,28+/m1/s1
InChI key： HVSPPOWIELNHFF-KPOFERKLSA-N
SMILES： COc1ccc(CO[C@@H]2[C@H]3CC[C@@](CC=C)([C@@H]2OC(=O)C(=O)c2ccccc2)C3(C)C)cc1
Systematic name  (3)：
  • α-フェニルグリオキシル酸(1S,4α)-1β-アリル-3α-(4-メトキシベンジルオキシ)-7,7-ジメチルビシクロ[2.2.1]ヘプタン-2α-イル
  • (1S,2S,3R,4S)-3-[(4-メトキシフェニル)メトキシ]-7,7-ジメチル-1-(プロパ-2-エン-1-イル)ビシクロ[2.2.1]ヘプタン-2-イル 2-オキソ-2-フェニルアセタート
  • (1S,2S,3R,4S)-3-[(4-methoxyphenyl)methoxy]-7,7-dimethyl-1-(prop-2-en-1-yl)bicyclo[2.2.1]heptan-2-yl 2-oxo-2-phenylacetate
Other name (1)：
  • α-Phenylglyoxylic acid (1S,4α)-1β-allyl-3α-(4-methoxybenzyloxy)-7,7-dimethylbicyclo[2.2.1]heptane-2α-yl ester
Thsaurus map：
Thesaurus Map

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