Gymnemic acid xiv

Base Information

• Chemical Name: Gymnemic acid xiv
• CAS No.: 155023-62-4
• Molecular Formula: C41H64 O13
• UNII: 7I0K42923T
• Mol file: 155023-62-4.mol

Synonyms:Gymnemic acid xiv;UNII-7I0K42923T;7I0K42923T;155023-62-4;Gymnemic acid xiv (constituent of gymnema) [DSC];beta-D-Glucopyranosiduronic acid, (3beta,4alpha,16beta,21beta,22alpha)-16,21,22,23-tetrahydroxy-28-(((2E)-2-methyl-1-oxo-2-buten-1-yl)oxy)olean-12-en-3-yl;Gymnemic acid xiv (constituent of gymnema);Q27268326;.BETA.-D-GLUCOPYRANOSIDURONIC ACID, (3.BETA.,4.ALPHA.,16.BETA.,21.BETA.,22.ALPHA.)-16,21,22,23-TETRAHYDROXY-28-(((2E)-2-METHYL-1-OXO-2-BUTEN-1-YL)OXY)OLEAN-12-EN-3-YL

Chemical Property of Gymnemic acid xiv

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 8
• Exact Mass: 764.43469209
• Heavy Atom Count: 54
• Complexity: 1540

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC=C(C)C(=O)OCC12C(CC(C(C1O)O)(C)C)C3=CCC4C5(CCC(C(C5CCC4(C3(CC2O)C)C)(C)CO)OC6C(C(C(C(O6)C(=O)O)O)O)O)C
• Isomeric SMILES: C/C=C(\C)/C(=O)OC[C@@]12[C@H](C[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H]([C@@]5(C)CO)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O)C)C)[C@@H]1CC([C@H]([C@@H]2O)O)(C)C)C)O