Tetrodotoxins
Product Code
CIF-CRM-03-TTXS
CAS Number
3 AnalytesProduct Format
Single Solution
Matrix
Aqueous Acetic Acid
Product Categories
Product Information
Analyte Name
Concentration
CAS Number
Molecular Structure
4,9-Anhydrotetrodotoxin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H15 N3 O7
Molecular Weight
301.25
Accurate Mass
301.091
SMILES
NC1=N[C@@]23[C@H](O)[C@@H]4O[C@@]5(O)O[C@H]([C@@H]2[C@@H](N1)O[C@@H]35)[C@@]4(O)CO
InChI
InChI=1S/C11H15N3O7/c12-8-13-6-2-4-9(17,1-15)5-3(16)10(2,14-8)7(19-6)11(18,20-4)21-5/h2-7,15-18H,1H2,(H3,12,13,14)/t2-,3-,4-,5+,6+,7+,9+,10-,11+/m1/s1
4-epi Tetrodotoxin
CAS Number
Alternate CAS Number
-
Unlabelled CAS Number
-
Molecular Formula
C11 H17 N3 O8
Molecular Weight
319.268
Accurate Mass
319.1016
SMILES
NC1=N[C@@H](O)[C@H]2[C@H]3O[C@]4(O)O[C@@H]([C@@H](O)[C@@]2(N1)[C@@H]4O)[C@]3(O)CO
InChI
InChI=1S/C11H17N3O8/c12-8-13-6(17)2-4-9(19,1-15)5-3(16)10(2,14-8)7(18)11(20,21-4)22-5/h2-7,15-20H,1H2,(H3,12,13,14)/t2-,3-,4-,5+,6+,7+,9+,10-,11+/m1/s1
Tetrodotoxin
CAS Number
Alternate CAS Number
Unlabelled CAS Number
-
Molecular Formula
C11 H17 N3 O8
Molecular Weight
319.27
Accurate Mass
319.1016
SMILES
OC[C@@]1(O)[C@H]2O[C@@]3(O)O[C@@H]1[C@@H]4[C@@H](O)NC(=N)N[C@]4([C@@H]2O)[C@@H]3O
InChI
InChI=1S/C11H17N3O8/c12-8-13-6(17)2-4-9(19,1-15)5-3(16)10(2,14-8)7(18)11(20,21-4)22-5/h2-7,15-20H,1H2,(H3,12,13,14)/t2-,3-,4-,5+,6-,7+,9+,10-,11+/m1/s1
Storage Temperature
-80°C
Shipping Temperature
-80°C
Country of Origin
SPAIN
Product Format
Single Solution
Matrix
Aqueous Acetic Acid