Bufotalin

Upper classes

IDs and Links
LipidBank	[1]
LipidMaps	[2]
CAS	471-95-4
KEGG	{{{KEGG}}}
KNApSAcK	[3]
CDX file
MOL file	Bufotalin.mol

3.beta.,14,16.beta.-Trihydroxy-, 5.beta.-bufa-20,22-dienolide, 16-acetate
Structural Information
Systematic Name	(3.beta.,5.beta.,16.beta.)-, 16-(acetyloxy)-3,14-Dihydroxy-, bufa-20,22-dienolide
Common Name	3.beta.,14,16.beta.-Trihydroxy-, 5.beta.-bufa-20,22-dienolide, 16-acetate 3.beta.,14,16.beta.-Trihydroxy-5.beta.-bufa-20,22-dienolide 16-acetate Bufotalin
Symbol
Formula	C26H36O6
Exact Mass	444.251188884
Average Mass	444.56043999999997
SMILES	C(C1([H])2)CC(C4C(C=5)=COC(=O)C5)(C(CC(OC(C)=O)4)(C1([H])CCC([H])(C3)C2(C)CCC3O)O)C
Physicochemical Information
Melting Point
Boiling Point
Density
Optical Rotation
Reflactive Index
Solubility
Spectral Information
Mass Spectra
UV Spectra
IR Spectra
NMR Spectra
Chromatograms