Tigloylgomisin H

Base Information

• Chemical Name: Tigloylgomisin H
• CAS No.: 66069-55-4
• Molecular Formula: C28H36O8
• Molecular Weight: 500.6
• UNII: 563Q173U7G
• Nikkaji Number: J815.753G
• Wikidata: Q27261371
• Metabolomics Workbench ID: 121996
• ChEMBL ID: CHEMBL1093179
• Mol file: 66069-55-4.mol

Synonyms:tigloylgomisin H

Chemical Property of Tigloylgomisin H

Chemical Property:

• PKA: 14.56±0.40(Predicted)
• XLogP3: 5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 8
• Exact Mass: 500.24101810
• Heavy Atom Count: 36
• Complexity: 771

Purity/Quality:

≥98% ^*data from raw suppliers

TigloylgomisinH 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC=C(C)C(=O)OC1=C2C(=CC(=C1OC)OC)CC(C(CC3=CC(=C(C(=C32)OC)OC)OC)(C)O)C
• Isomeric SMILES: C/C=C(\C)/C(=O)OC1=C2C(=CC(=C1OC)OC)C[C@@H]([C@@](CC3=CC(=C(C(=C32)OC)OC)OC)(C)O)C