Anemarrhenasaponin I

Base Information

• Chemical Name: Anemarrhenasaponin I
• CAS No.: 163047-22-1
• Molecular Formula: C39H66 O14
• DSSTox Substance ID: DTXSID601314781
• Wikidata: Q105380204

Synonyms:Anemarrhenasaponin I;Anemarrhenasaponin II;163047-21-0;DTXSID601314781;AKOS037515310;B0005-479858;163047-22-1

Chemical Property of Anemarrhenasaponin I

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 9
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 9
• Exact Mass: 758.44525677
• Heavy Atom Count: 53
• Complexity: 1270

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• Canonical SMILES: CC1C2C(C(C3C2(CCC4C3CCC5C4(CCC(C5)OC6C(C(C(C(O6)CO)O)O)OC7C(C(C(C(O7)CO)O)O)O)C)C)O)OC1(CCC(C)C)O

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