(1S,1aR,1bS,4aR,7aS,7bR,8R,9aS)-1-(Acetoxymethyl)-4a,7b-dihydroxy-3-(hydroxymethyl)-1,6,8-trimethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl (E)-2-methylbut-2-enoate

Base Information

• Chemical Name: (1S,1aR,1bS,4aR,7aS,7bR,8R,9aS)-1-(Acetoxymethyl)-4a,7b-dihydroxy-3-(hydroxymethyl)-1,6,8-trimethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl (E)-2-methylbut-2-enoate
• CAS No.: 39071-30-2
• Molecular Formula: C27H36 O8
• Molecular Weight: 488.63
• Mol file: 39071-30-2.mol

Synonyms:LS-58500;39071-30-2;LS 58500;(1S,1aR,1bS,4aR,7aS,7bR,8R,9aS)-1-(Acetoxymethyl)-4a,7b-dihydroxy-3-(hydroxymethyl)-1,6,8-trimethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl (E)-2-methylbut-2-enoate;5H-Cyclopropa(3,4)benz(1,2-e)azulen-5-one, 1,1a-alpha,1b-beta,4,4a,7a-alpha,7b,8,9,9a-decahydro-4a-alpha,7b-alpha,9a-alpha-trihydroxy-3-hydroxymethyl-1,6,8-alpha-trimethyl-1-acetoxymethyl-, 9a-(2-methylbut-2-enoate);AKOS040752693;[(1R,2S,6R,10S,11R,12S,13S,15R)-12-(Acetyloxymethyl)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,15-trimethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] (E)-2-methylbut-2-enoate

Chemical Property of (1S,1aR,1bS,4aR,7aS,7bR,8R,9aS)-1-(Acetoxymethyl)-4a,7b-dihydroxy-3-(hydroxymethyl)-1,6,8-trimethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl (E)-2-methylbut-2-enoate

Chemical Property:

• Vapor Pressure: 2.03E-18mmHg at 25°C
• Boiling Point: 628.2°Cat760mmHg
• Flash Point: 204.6°C
• Density: 1.3g/cm³
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 488.24101810
• Heavy Atom Count: 35
• Complexity: 1070

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=C(C)C(=O)OC12CC(C3(C(C1C2(C)COC(=O)C)C=C(CC4(C3C=C(C4=O)C)O)CO)O)C
• Isomeric SMILES: C/C=C(\C)/C(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1[C@@]2(C)COC(=O)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)CO)O)C