8alpha-(2-Methylacryloyloxy)-1-O-methylhirsutinolide 13-O-acetate

Base Information

• Chemical Name: 8alpha-(2-Methylacryloyloxy)-1-O-methylhirsutinolide 13-O-acetate
• CAS No.: 883872-71-7
• Molecular Formula: C22H28O8
• Molecular Weight: 420.5
• ChEMBL ID: CHEMBL2062867
• Nikkaji Number: J3.469.777I
• Mol file: 883872-71-7.mol

Synonyms:883872-71-7;8alpha-(2-Methylacryloyloxy)-1-O-methylhirsutinolide 13-O-acetate;CHEMBL2062867;AKOS026674279

Chemical Property of 8alpha-(2-Methylacryloyloxy)-1-O-methylhirsutinolide 13-O-acetate

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 420.17841785
• Heavy Atom Count: 30
• Complexity: 853

Purity/Quality:

96.5% ^*data from raw suppliers

8α-(2-Methylacryloyloxy)-1-O-methylhirsutinolide13-O-acetate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1CC(C2=C(C(=O)OC2=CC3(CCC1(O3)OC)C)COC(=O)C)OC(=O)C(=C)C
• Isomeric SMILES: C[C@@H]1C[C@@H](C\2=C(C(=O)O/C2=C/[C@]3(CC[C@@]1(O3)OC)C)COC(=O)C)OC(=O)C(=C)C

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