Chem
J-GLOBAL ID：200907070722554858   Nikkaji number：J2.085.184H

(4R,5S)-4-[(1R)-1-Hydroxy-2-propenyl]-4-[[(4S)-2,2-dimethyl-4-(tert-butyloxycarbonyl)-4-oxazolidinyl]methyl]-5-[(1R)-1-(4-methoxybenzyloxy)-2-propenyl]-2,2-dimethyl-1,3-dioxolane

(4R,5S)-4-[(1R)-1-ヒドロキシ-2-プロペニル]-4-[[(4S)-2,2-ジメチル-4-(tert-ブチルオキシカルボニル)-4-オキサゾリジニル]メチル]-5-[(1R)-1-(4-メトキシベンジルオキシ)-2-プロペニル]-2,2-ジメチル-1,3-ジオキソラン
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： C30H45NO8
Molecular formula furigana： C30-H45-N-O8
Molecular weight： 547.689
InChI： InChI=1S/C30H45NO8/c1-11-22(35-17-20-13-15-21(34-10)16-14-20)24-30(23(32)12-2,39-28(8,9)37-24)18-29(19-36-27(6,7)31-29)25(33)38-26(3,4)5/h11-16,22-24,31-32H,1-2,17-19H2,3-10H3/t22-,23-,24+,29+,30-/m1/s1
InChI key： NIYMXNPIFXFYLG-USLFWMELSA-N
SMILES： COc1ccc(CO[C@H](C=C)[C@@H]2OC(C)(C)O[C@]2(C[C@]2(COC(C)(C)N2)C(=O)OC(C)(C)C)[C@H](O)C=C)cc1
Systematic name  (3)：
  • (4R,5S)-4-[(1R)-1-ヒドロキシ-2-プロペニル]-4-[[(4S)-2,2-ジメチル-4-(tert-ブチルオキシカルボニル)-4-オキサゾリジニル]メチル]-5-[(1R)-1-(4-メトキシベンジルオキシ)-2-プロペニル]-2,2-ジメチル-1,3-ジオキソラン
  • tert-ブチル (4S)-4-{[(4R,5S)-4-[(1R)-1-ヒドロキシプロパ-2-エン-1-イル]-5-[(1R)-1-[(4-メトキシフェニル)メトキシ]プロパ-2-エン-1-イル]-2,2-ジメチル-1,3-ジオキソラン-4-イル]メチル}-2,2-ジメチル-1,3-オキサゾリジン-4-カルボキシラート
  • tert-butyl (4S)-4-{[(4R,5S)-4-[(1R)-1-hydroxyprop-2-en-1-yl]-5-[(1R)-1-[(4-methoxyphenyl)methoxy]prop-2-en-1-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]methyl}-2,2-dimethyl-1,3-oxazolidine-4-carboxylate
Other name (1)：
  • (4R,5S)-4-[(1R)-1-Hydroxy-2-propenyl]-4-[[(4S)-2,2-dimethyl-4-(tert-butyloxycarbonyl)-4-oxazolidinyl]methyl]-5-[(1R)-1-(4-methoxybenzyloxy)-2-propenyl]-2,2-dimethyl-1,3-dioxolane
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