Chem
J-GLOBAL ID：200907083145764796   Nikkaji number：J1.953.270D

(3aR,7aβ)-2-[(2R)-1-Methylene-2-(phenyldimethylsilyl)-2-(4-methoxyphenyl)ethyl]-3aβ,8,8-trimethyl-4β,6β-methanohexahydro-1,3,2-benzodioxaborole

(3aR,7aβ)-2-[(2R)-1-メチレン-2-(フェニルジメチルシリル)-2-(4-メトキシフェニル)エチル]-3aβ,8,8-トリメチル-4β,6β-メタノヘキサヒドロ-1,3,2-ベンゾジオキサボロール
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： C28H37BO3Si
Molecular formula furigana： C28-H37-B-O3-SI
Molecular weight： 460.500
InChI： InChI=1S/C28H37BO3Si/c1-19(29-31-25-18-21-17-24(27(21,2)3)28(25,4)32-29)26(20-13-15-22(30-5)16-14-20)33(6,7)23-11-9-8-10-12-23/h8-16,21,24-26H,1,17-18H2,2-7H3/t21-,24-,25+,26-,28-/m1/s1
InChI key： VTDOXQMCDRUORZ-ZKPBLSLZSA-N
SMILES： COc1ccc(cc1)[C@@H](C(=C)B1O[C@H]2C[C@H]3C[C@H](C3(C)C)[C@@]2(C)O1)[Si](C)(C)c1ccccc1
Systematic name  (3)：
  • (3aR,7aβ)-2-[(2R)-1-メチレン-2-(フェニルジメチルシリル)-2-(4-メトキシフェニル)エチル]-3aβ,8,8-トリメチル-4β,6β-メタノヘキサヒドロ-1,3,2-ベンゾジオキサボロール
  • [(1R)-1-(4-メトキシフェニル)-2-[(1R,2R,6S,8R)-2,9,9-トリメチル-3,5-ジオキサ-4-ボラトリシクロ[6.1.1.02,6]デカン-4-イル]プロパ-2-エン-1-イル]ジメチルフェニルシラン
  • [(1R)-1-(4-methoxyphenyl)-2-[(1R,2R,6S,8R)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]prop-2-en-1-yl]dimethylphenylsilane
Other name (1)：
  • (3aR,7aβ)-2-[(2R)-1-Methylene-2-(phenyldimethylsilyl)-2-(4-methoxyphenyl)ethyl]-3aβ,8,8-trimethyl-4β,6β-methanohexahydro-1,3,2-benzodioxaborole
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