Chem
J-GLOBAL ID：200907027824509510   Nikkaji number：J2.244.076D

(1S)-1α,2-[[(2S)-3-Hydroxy-3-methylbutane-1,2-diyl]oxy]-3-iodo-5α-isobutyryl-6,6-dimethyl-7β-(3-methyl-2-butenyl)bicyclo[3.3.1]nonane-2-ene-4,9-dione

(1S)-1α,2-[[(2S)-3-ヒドロキシ-3-メチルブタン-1,2-ジイル]オキシ]-3-ヨード-5α-イソブチリル-6,6-ジメチル-7β-(3-メチル-2-ブテニル)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： C25H35IO5
Molecular formula furigana： C25-H35-I-O5
Molecular weight： 542.454
InChI： InChI=1S/C25H35IO5/c1-13(2)9-10-15-11-24-12-16(23(7,8)30)31-20(24)17(26)19(28)25(21(24)29,22(15,5)6)18(27)14(3)4/h9,14-16,30H,10-12H2,1-8H3/t15-,16-,24-,25-/m0/s1
InChI key： WFRHFDNKUWHKDQ-WSCLJCSOSA-N
SMILES： CC(C)C(=O)[C@@]12C(=O)C(=C3O[C@@H](C[C@]3(C[C@H](CC=C(C)C)C1(C)C)C2=O)C(C)(C)O)I
Systematic name  (3)：
  • (1S)-1α,2-[[(2S)-3-ヒドロキシ-3-メチルブタン-1,2-ジイル]オキシ]-3-ヨード-5α-イソブチリル-6,6-ジメチル-7β-(3-メチル-2-ブテニル)ビシクロ[3.3.1]ノナン-2-エン-4,9-ジオン
  • (1S,3S,8S,10S)-3-(2-ヒドロキシプロパン-2-イル)-6-ヨード-9,9-ジメチル-10-(3-メチルブタ-2-エン-1-イル)-8-(2-メチルプロパノイル)-4-オキサトリシクロ[6.3.1.01,5]ドデカ-5-エン-7,12-ジオン
  • (1S,3S,8S,10S)-3-(2-hydroxypropan-2-yl)-6-iodo-9,9-dimethyl-10-(3-methylbut-2-en-1-yl)-8-(2-methylpropanoyl)-4-oxatricyclo[6.3.1.01,5]dodec-5-ene-7,12-dione
Other name (1)：
  • (1S)-1α,2-[[(2S)-3-Hydroxy-3-methylbutane-1,2-diyl]oxy]-3-iodo-5α-isobutyryl-6,6-dimethyl-7β-(3-methyl-2-butenyl)bicyclo[3.3.1]nonane-2-ene-4,9-dione
Thsaurus map：
Thesaurus Map

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