Chem
J-GLOBAL ID:200907077468727202   Nikkaji number:J1.781.700K

(R)-2-Methylhexanoic acid (1R,2R,3S,4R)-3-(4-methoxybenzyl)-1,7,7-trimethylbicyclo[2.2.1]heptane-2-yl ester

(R)-2-メチルヘキサン酸(1R,2R,3S,4R)-3-(4-メトキシベンジル)-1,7,7-トリメチルビシクロ[2.2.1]ヘプタン-2-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: C25H38O3
Molecular formula furigana: C25-H38-O3
Molecular weight: 386.576
InChI: InChI=1S/C25H38O3/c1-7-8-9-17(2)23(26)28-22-20(16-18-10-12-19(27-6)13-11-18)21-14-15-25(22,5)24(21,3)4/h10-13,17,20-22H,7-9,14-16H2,1-6H3/t17-,20+,21-,22-,25+/m1/s1
InChI key: AIYZOVNZXXHDRP-NEMUNFNQSA-N
SMILES: CCCC[C@@H](C)C(=O)O[C@@H]1[C@@H](Cc2ccc(OC)cc2)[C@H]2CC[C@]1(C)C2(C)C
Systematic name  (3):
  • (R)-2-メチルヘキサン酸(1R,2R,3S,4R)-3-(4-メトキシベンジル)-1,7,7-トリメチルビシクロ[2.2.1]ヘプタン-2-イル
  • (1R,2R,3S,4R)-3-[(4-メトキシフェニル)メチル]-1,7,7-トリメチルビシクロ[2.2.1]ヘプタン-2-イル (2R)-2-メチルヘキサノアート
  • (1R,2R,3S,4R)-3-[(4-methoxyphenyl)methyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl (2R)-2-methylhexanoate
Other name (1):
  • (R)-2-Methylhexanoic acid (1R,2R,3S,4R)-3-(4-methoxybenzyl)-1,7,7-trimethylbicyclo[2.2.1]heptane-2-yl ester
Thsaurus map:

Return to Previous Page