11-Hydroxysaxitoxin Sulfate
[CAS# 125604-84-4]

Identification

• Name: 11-Hydroxysaxitoxin Sulfate
• Molecular Formula: C₁₀H₁₇N₇O₁₂S₂
• Molecular Weight: 491.40
• CAS Registry Number: 125604-84-4
• SMILES: [C@@H]13NC(=NC12N(CC(O[S](O)(=O)=O)(O[S](O)(=O)=O)C2(O)O)C(=N[C@H]3COC(=O)N)N)N
• InChI: 1S/C10H17N7O12S2/c11-5-15-4-3(1-27-7(13)18)14-6(12)17-2-8(28-30(21,22)23,29-31(24,25)26)10(19,20)9(4,17)16-5/h3-4,19-20H,1-2H2,(H2,12,14)(H2,13,18)(H3,11,15,16)(H,21,22,23)(H,24,25,26)/t3-,4-,9?/m0/s1
• InChIKey: BLVHVLVATWRIQR-RQGHCTOOSA-N

Properties

• Density: 2.646g/cm³ (Cal.)