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Butanoic acid,2-methyl-,(1R,4R,4aR,5S,6R,8S,8aR)-8a-[(acetyloxy)methyl]-5-[(2S)-2-(2,5-dihydro-5-oxo-3-furanyl)-2-hydroxyethyl]octahydro-8-hydroxy-5,6-dimethylspiro[naphthalene-1(2H),2'-oxiran]-4-ylester, (2S)- (121449-66-9)

Identification
Name:Butanoic acid,2-methyl-,(1R,4R,4aR,5S,6R,8S,8aR)-8a-[(acetyloxy)methyl]-5-[(2S)-2-(2,5-dihydro-5-oxo-3-furanyl)-2-hydroxyethyl]octahydro-8-hydroxy-5,6-dimethylspiro[naphthalene-1(2H),2'-oxiran]-4-ylester, (2S)-
Synonyms:Butanoicacid, 2-methyl-,8a-[(acetyloxy)methyl]-5-[2-(2,5-dihydro-5-oxo-3-furanyl)-2-hydroxyethyl]octahydro-8-hydroxy-5,6-dimethylspiro[naphthalene-1(2H),2'-oxiran]-4-ylester, [1R-[1a,4b(S*),4ab,5b(S*),6a,8a,8aa]]-; Ajugamarin B 3
CAS:121449-66-9
Molecular Formula: C27H40 O9
Molecular Weight: 508.6011
InChI: InChI=1/C27H40O9/c1-6-15(2)24(32)36-20-7-8-26(13-35-26)27(14-34-17(4)28)21(30)9-16(3)25(5,23(20)27)11-19(29)18-10-22(31)33-12-18/h10,15-16,19-21,23,29-30H,6-9,11-14H2,1-5H3/t15-,16+,19-,20+,21-,23+,25-,26?,27+/m0/s1
Molecular Structure: (C27H40O9) Butanoicacid, 2-methyl-,8a-[(acetyloxy)methyl]-5-[2-(2,5-dihydro-5-oxo-3-furanyl)-2-hydroxyethyl]oct...
Properties
Flash Point: 212.6°C
Boiling Point: 656°C at 760 mmHg
Density:1.26g/cm3
Refractive index:1.552
Flash Point: 212.6°C
Safety Data
 

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