[(1R,4aR,5S,7R,8S,8aR)-5-acetyloxy-4a-(acetyloxymethyl)-8-[(2S)-2-acetyloxy-2-(5-oxo-2H-furan-3-yl)ethyl]-7,8-dimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-1-yl] (2S)-2-methylbutanoate

Names

[ CAS No. ]:
121449-65-8

[ Name ]:
[(1R,4aR,5S,7R,8S,8aR)-5-acetyloxy-4a-(acetyloxymethyl)-8-[(2S)-2-acetyloxy-2-(5-oxo-2H-furan-3-yl)ethyl]-7,8-dimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-1-yl] (2S)-2-methylbutanoate

[Synonym ]:
Ajugamarin B 1
dihydroajugamarin

Chemical & Physical Properties

[ Density]:
1.23g/cm3

[ Boiling Point ]:
660.2ºC at 760mmHg

[ Molecular Formula ]:
C31H44O11

[ Molecular Weight ]:
592.67400

[ Flash Point ]:
273.3ºC

[ Exact Mass ]:
592.28800

[ PSA ]:
144.03000

[ LogP ]:
3.45560

[ Vapour Pressure ]:
2.64E-17mmHg at 25°C

[ Index of Refraction ]:
1.531

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • (1R,4R,4aR,5S,7R,8S,8aR)-5-acetoxy-4a-(acetoxymethyl)-4-(chloromethyl)-4-hydroxy-8-((S)-2-hydroxy-2-(5-oxo-2,5-dihydrofuran-3-yl)ethyl)-7,8-dimethyldecahydronaphthalen-1-yl (S)-2-methylbutanoate
  • Ethanoic anhydride
  • [5-acetyloxy-8-[2-acetyloxy-2-(5-oxo-2H-furan-3-yl)ethyl]-4a-(hydroxymethyl)-7,8-dimethylspiro[2,3,5,6,7,8a-hexahydro-1H-naphthalene-4,2'-oxirane]-1-yl] 2-methylbutanoate

DownStream

Related Compounds

  • 1-({[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-5-methylphenyl]formamido}methyl)cyclopropane-1-carboxylic acid
  • 1-[4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanamido]cyclopentane-1-carboxylic acid
  • 3-{[2-(tert-butoxy)ethyl]carbamoyl}-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid
  • 1-[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methylpropanoyl]-4-methylpyrrolidine-3-carboxylic acid
  • 3-[2-cyclopropyl-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-N-methylpropanamido]propanoic acid
  • 2-[(2S)-N-ethyl-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3,3-dimethylbutanamido]acetic acid
  • (2R)-2-{[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)cyclohexyl]formamido}propanoic acid
  • 3-ethyl-1-[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoyl]pyrrolidine-3-carboxylic acid
  • 1-[(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoyl]-3-methylpiperidine-3-carboxylic acid
  • 3-[(2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3,3-dimethylbutanamido]-2-methylpropanoic acid
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