Chem
J-GLOBAL ID:200907026584360096   Nikkaji number:J2.083.437D

2,4-Dimethyl-3,5-dioxo-5-[(1S,4S,5R,6S)-1,3,6-trimethyl-4-[(1E,3R,4R)-1,3-dimethyl-4-(tert-butyldimethylsiloxy)-1-hexenyl]bicyclo[3.1.0]hexa-2-ene-6-yl]valeric acid methyl ester

2,4-ジメチル-3,5-ジオキソ-5-[(1S,4S,5R,6S)-1,3,6-トリメチル-4-[(1E,3R,4R)-1,3-ジメチル-4-(tert-ブチルジメチルシロキシ)-1-ヘキセニル]ビシクロ[3.1.0]ヘキサ-2-エン-6-イル]吉草酸メチル
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: C31H52O5Si
Molecular formula furigana: C31-H52-O5-SI
Molecular weight: 532.837
InChI: InChI=1S/C31H52O5Si/c1-15-23(36-37(13,14)29(7,8)9)18(2)16-19(3)24-20(4)17-30(10)26(24)31(30,11)27(33)21(5)25(32)22(6)28(34)35-12/h16-18,21-24,26H,15H2,1-14H3/b19-16+/t18-,21?,22?,23-,24+,26-,30+,31-/m1/s1
InChI key: WFEKKOXIMIBWBG-WTEPWVTRSA-N
SMILES: CC[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](C)/C=C(\C)/[C@@H]1[C@@H]2[C@](C)(C=C1C)[C@@]2(C)C(=O)C(C)C(=O)C(C)C(=O)OC
Systematic name  (3):
  • 2,4-ジメチル-3,5-ジオキソ-5-[(1S,4S,5R,6S)-1,3,6-トリメチル-4-[(1E,3R,4R)-1,3-ジメチル-4-(tert-ブチルジメチルシロキシ)-1-ヘキセニル]ビシクロ[3.1.0]ヘキサ-2-エン-6-イル]吉草酸メチル
  • メチル 5-[(1S,4S,5R,6S)-4-[(2E,4R,5R)-5-[(tert-ブチルジメチルシリル)オキシ]-4-メチルヘプタ-2-エン-2-イル]-1,3,6-トリメチルビシクロ[3.1.0]ヘキサ-2-エン-6-イル]-2,4-ジメチル-3,5-ジオキソペンタノアート
  • methyl 5-[(1S,4S,5R,6S)-4-[(2E,4R,5R)-5-[(tert-butyldimethylsilyl)oxy]-4-methylhept-2-en-2-yl]-1,3,6-trimethylbicyclo[3.1.0]hex-2-en-6-yl]-2,4-dimethyl-3,5-dioxopentanoate
Other name (1):
  • 2,4-Dimethyl-3,5-dioxo-5-[(1S,4S,5R,6S)-1,3,6-trimethyl-4-[(1E,3R,4R)-1,3-dimethyl-4-(tert-butyldimethylsiloxy)-1-hexenyl]bicyclo[3.1.0]hexa-2-ene-6-yl]valeric acid methyl ester
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