Chem
J-GLOBAL ID：200907080526663687   Nikkaji number：J2.244.079I

(1S)-1α-[[(4S)-2-Oxo-5,5-dimethyl-1,3-dioxolane-4β-yl]methyl]-5α-isobutyryl-6,6-dimethyl-7β-(3-hydroxy-3-methylbutyl)bicyclo[3.3.1]nonane-2-ene-4,9-dione

(1S)-1α-[[(4S)-2-オキソ-5,5-ジメチル-1,3-ジオキソラン-4β-イル]メチル]-5α-イソブチリル-6,6-ジメチル-7β-(3-ヒドロキシ-3-メチルブチル)ビシクロ[3.3.1]ノナン-2-エン-4,9-ジオン
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： C26H38O7
Molecular formula furigana： C26-H38-O7
Molecular weight： 462.583
InChI： InChI=1S/C26H38O7/c1-15(2)19(28)26-17(27)10-12-25(20(26)29,14-18-24(7,8)33-21(30)32-18)13-16(23(26,5)6)9-11-22(3,4)31/h10,12,15-16,18,31H,9,11,13-14H2,1-8H3/t16-,18-,25-,26+/m0/s1
InChI key： LXVYYHVRWWXHNR-IWDAMJOHSA-N
SMILES： CC(C)C(=O)[C@@]12C(=O)C=C[C@@](C[C@@H]3OC(=O)OC3(C)C)(C[C@H](CCC(C)(C)O)C1(C)C)C2=O
Systematic name  (3)：
  • (1S)-1α-[[(4S)-2-オキソ-5,5-ジメチル-1,3-ジオキソラン-4β-イル]メチル]-5α-イソブチリル-6,6-ジメチル-7β-(3-ヒドロキシ-3-メチルブチル)ビシクロ[3.3.1]ノナン-2-エン-4,9-ジオン
  • (1R,5S,7S)-5-{[(4S)-5,5-ジメチル-2-オキソ-1,3-ジオキソラン-4-イル]メチル}-7-(3-ヒドロキシ-3-メチルブチル)-8,8-ジメチル-1-(2-メチルプロパノイル)ビシクロ[3.3.1]ノナ-3-エン-2,9-ジオン
  • (1R,5S,7S)-5-{[(4S)-5,5-dimethyl-2-oxo-1,3-dioxolan-4-yl]methyl}-7-(3-hydroxy-3-methylbutyl)-8,8-dimethyl-1-(2-methylpropanoyl)bicyclo[3.3.1]non-3-ene-2,9-dione
Other name (1)：
  • (1S)-1α-[[(4S)-2-Oxo-5,5-dimethyl-1,3-dioxolane-4β-yl]methyl]-5α-isobutyryl-6,6-dimethyl-7β-(3-hydroxy-3-methylbutyl)bicyclo[3.3.1]nonane-2-ene-4,9-dione
Thsaurus map：
Thesaurus Map

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