(5S)-6,8t,10c-triacetoxy-8c-acetoxymethyl-(3at,7at,10bt)-3a,5,6,7a,8,9,10,10b-octahydro-1(3)H-5r,10ac-cyclo-6c,9c-epioxido-[1,4]dioxepino[5,6,7-de]quinazolin-2-ylamine, toluene-4-sulfonate
Names
[ CAS No. ]:
5141-89-9
[ Name ]:
(5S)-6,8t,10c-triacetoxy-8c-acetoxymethyl-(3at,7at,10bt)-3a,5,6,7a,8,9,10,10b-octahydro-1(3)H-5r,10ac-cyclo-6c,9c-epioxido-[1,4]dioxepino[5,6,7-de]quinazolin-2-ylamine, toluene-4-sulfonate
[Synonym ]:
tetra-O-acetyl-(4βO)-4,9-anhydro-tetrodotoxin, toluene-4-sulfonate
Chemical & Physical Properties
[ Molecular Formula ]:
C26H31N3O14S
[ Molecular Weight ]:
641.60100
[ Exact Mass ]:
641.15300
[ PSA ]:
246.05000
[ LogP ]:
0.59620