Serpentintartrat

(2R,3R)-2,3-dihydroxybutanedioic acid;methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate

Also Known As: Serpentintartrat|Serpentintartrat [German]|SERPENTINE TARTRATE|3-beta,20-alpha-Yohimban-16-beta-carboxylic acid, 18-beta-hydroxy-11,17-alpha-dimethoxy-, methyl ester, 3,4,5-trimethoxybenzoate (ester), tartrate|Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-((3,4,5-trimethoxybenzoyl)oxy)-, methyl ester, (3beta,16beta,17alpha,18beta,20alpha)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)|Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]-, methyl ester, (3.beta.,16.beta.,17.alpha.,18.beta.,20.alpha.)-, [R-(R*,R*)]-2,3-dihydroxybutanedioate (1:1)

Molecular Formula	C37H46N2O15
Molecular Weight	758.2898 g/mol
LogP	2.0485
Topological Polar Surface Area	232.84 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	14
Rotatable Bonds	11
Exact Mass	758.2898
Monoisotopic Mass	758.2898
Heavy Atoms	54
Complexity	1816.8093

Chemical Identifiers

CAS Number	78329-75-6
SMILES	CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O