Apigenin-7-O-sophroside

Base Information

• Chemical Name: Apigenin-7-O-sophroside
• CAS No.: 52073-83-3
• Molecular Formula: C27H30O15
• Molecular Weight: 594.5
• Nikkaji Number: J866.650D

Synonyms:Apigenin-7-O-sophroside;52073-83-3;Apigenin 7-O-sophoroside;7-[(2S,3R,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one;HY-N6604;CS-0034338;F17708;APIGENIN-7-O-SOPHROSIDEAPIGENIN-7-O-BETA-D-SOPHOROSIDE

Chemical Property of Apigenin-7-O-sophroside

Chemical Property:

• PKA: 6.11±0.40(Predicted)
• XLogP3: -1.7
• Hydrogen Bond Donor Count: 9
• Hydrogen Bond Acceptor Count: 15
• Rotatable Bond Count: 7
• Exact Mass: 594.15847025
• Heavy Atom Count: 42
• Complexity: 956

Purity/Quality:

99%, ^*data from raw suppliers

Apigenin-7-O-sophroside ≥97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O
• Isomeric SMILES: C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O

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