Dihydrocatalpol

Base Information

• Chemical Name: Dihydrocatalpol
• CAS No.: 6736-86-3
• Molecular Formula: C₁₅H₂₄O₁₀
• Molecular Weight: 364.35
• DSSTox Substance ID: DTXSID001104596
• Wikidata: Q105187452
• ChEMBL ID: CHEMBL471185

Synonyms:Dihydrocatalpol;6736-86-3;beta-D-Glucopyranoside, (1aS,1bS,2S,6R,6aS,6bS)-octahydro-6-hydroxy-1a-(hydroxymethyl)oxireno[4,5]cyclopenta[1,2-c]pyran-2-yl;CHEMBL471185;DTXSID001104596;AKOS004901988;E89020

Chemical Property of Dihydrocatalpol

Chemical Property:

• XLogP3: -3.3
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 4
• Exact Mass: 364.13694696
• Heavy Atom Count: 25
• Complexity: 505

Purity/Quality:

Analysis standard,HPLC≥98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1COC(C2C1C(C3C2(O3)CO)O)OC4C(C(C(C(O4)CO)O)O)O
• Isomeric SMILES: C1CO[C@H]([C@H]2[C@@H]1[C@@H]([C@H]3[C@@]2(O3)CO)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O

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