Chem
J-GLOBAL ID：201407064995831765   Nikkaji number：J3.280.858A

(2R,3R,4S)-2-Isobutyl-3-hydroxy-4-methyl-5-(4-methoxybenzyloxy)pentanoic acid

(2R,3R,4S)-2-イソブチル-3-ヒドロキシ-4-メチル-5-(4-メトキシベンジルオキシ)ペンタン酸
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： C18H28O5
Molecular formula furigana： C18-H28-O5
Molecular weight： 324.417
InChI： InChI=1S/C18H28O5/c1-12(2)9-16(18(20)21)17(19)13(3)10-23-11-14-5-7-15(22-4)8-6-14/h5-8,12-13,16-17,19H,9-11H2,1-4H3,(H,20,21)/t13-,16+,17+/m0/s1
InChI key： RXXVLKUXHPBCQZ-IAOVAPTHSA-N
SMILES： COc1ccc(COC[C@H](C)[C@@H](O)[C@@H](CC(C)C)C(=O)O)cc1
Systematic name  (3)：
  • (2R,3R,4S)-2-イソブチル-3-ヒドロキシ-4-メチル-5-(4-メトキシベンジルオキシ)ペンタン酸
  • (2R,3R,4S)-3-ヒドロキシ-5-[(4-メトキシフェニル)メトキシ]-4-メチル-2-(2-メチルプロピル)ペンタン酸
  • (2R,3R,4S)-3-hydroxy-5-[(4-methoxyphenyl)methoxy]-4-methyl-2-(2-methylpropyl)pentanoic acid
Other name (1)：
  • (2R,3R,4S)-2-Isobutyl-3-hydroxy-4-methyl-5-(4-methoxybenzyloxy)pentanoic acid
Thsaurus map：
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