Delpheline

Base Information

• Chemical Name: Delpheline
• CAS No.: 509-28-4
• Molecular Formula: C₂₅H₃₉NO₆
• Molecular Weight: 449.588
• Wikidata: Q105232333

Synonyms:Delpheline;2,3-Dihydrodeacetyltatsiensine;20-Ethyl-1,14,16-trimethoxy-4-methyl-7,8-(methylenebis(oxy))aconitan-6-ol (1alpha,6beta,14alpha,16beta)-;509-28-4;Aconitan-6-ol, 20-ethyl-1,14,16-trimethoxy-4-methyl-7,8-(methylenebis(oxy))-, (1alpha,6beta,14alpha,16beta)-

Chemical Property of Delpheline

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 449.27773796
• Heavy Atom Count: 32
• Complexity: 826

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1CC2(CCC(C34C2C(C5(C31)C6(CC(C7CC4C6C7OC)OC)OCO5)O)OC)C
• Isomeric SMILES: CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]2[C@@H]([C@@]5(C31)[C@]6(C[C@@H]([C@H]7C[C@@H]4[C@@H]6[C@H]7OC)OC)OCO5)O)OC)C

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