METHYL 3,12-DIOXOOLEAN-9(11)-EN-28-OATE

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Names

[ CAS No. ]:
218600-50-1

[ Name ]:
METHYL 3,12-DIOXOOLEAN-9(11)-EN-28-OATE

[Synonym ]:
Methyl 3,12-dioxoolean-9(11)-en-28-oate
Olean-9(11)-en-28-oic acid, 3,12-dioxo-, methyl ester
(4aS,6aR,6bS,12aS,14aR,14bR)-methyl-2,2,6a,6b,9,9,12a-heptamethyl-10,14-dioxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-4a-carboxylate
Olean-9(11)-en-28-oic acid, 3,12-dioxo-, methyl ester, (5ξ,18α)-
Olean-9(11)-en-28-oic acid,3,12-dioxo-,methyl ester
2,2,6a,6b,9,9,12a-Heptamethyl-10,14-dioxo-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-octadecahydro-2H-picene-4a-carboxylic acid methyl ester
Methyl (5ξ,18α)-3,12-dioxoolean-9(11)-en-28-oate

Chemical & Physical Properties

[ Density]:
1.1±0.1 g/cm3

[ Boiling Point ]:
557.1±50.0 °C at 760 mmHg

[ Molecular Formula ]:
C31H46O4

[ Molecular Weight ]:
482.694

[ Flash Point ]:
232.7±30.2 °C

[ Exact Mass ]:
482.339600

[ PSA ]:
60.44000

[ LogP ]:
6.82

[ Vapour Pressure ]:
0.0±1.5 mmHg at 25°C

[ Index of Refraction ]:
1.542

Synthetic Route

Precursor & DownStream

Precursor

  • Methyl (3α,5ξ,18α)-3-hydroxy-12-oxoolean-9(11)-en-28-oate
  • Methyl 3b-acetoxy-12-oxoolean-9(11)-en-28-oate
  • Methyl oleanolate
  • Oleanic acid
  • Methyl (3β)-3-acetoxy-12-oxooleanan-28-oate

DownStream

  • Bardoxolone
  • Bardoxolone Methyl
  • Methyl (5ξ,18α)-2-cyano-3-hydroxy-12-oxooleana-2,9(11)-dien-28-oa te
  • Methyl (2E,5ξ,18α)-2-(hydroxymethylene)-3,12-dioxoolean-9(11)-en- 28-oate
  • Methyl 12-oxoisoxazolo[4,5-b]olean-9(11)-en-28-oate

Related Compounds

  • Methyl (2E,5ξ,18α)-2-(hydroxymethylene)-3,12-dioxoolean-9(11)-en- 28-oate
  • Methyl (5ξ,18α)-2-cyano-3-hydroxy-12-oxooleana-2,9(11)-dien-28-oa te
  • methyl 10-acetyloxy-2,2,6a,6b,9,9,12a-heptamethyl-3-oxo-4,5,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylate
  • Methyl (3α,5ξ,18α)-3-hydroxy-12-oxoolean-9(11)-en-28-oate
  • Methyl 3b-acetoxy-12-oxoolean-9(11)-en-28-oate
  • Methyl 12-oxoisoxazolo[4,5-b]olean-9(11)-en-28-oate