Gonyautoxin V
[CAS# 64296-25-9]

Identification

• Name: Gonyautoxin V
• Synonyms: Carbamic Acid, Sulfo-, C-((2,6-Diamino-3A,4,9,10-Tetrahydro-10,10-Dihydroxy-1H,8H-Pyrrolo(1,2-C)Purin-4-Yl)Methyl) Ester, (3As-(3Aalpha,4Alpha,10Ar*))-; Gonyautoxin V; Gonyautoxin-V
• Molecular Formula: C₁₀H₁₇N₇O₇S
• Molecular Weight: 379.35
• CAS Registry Number: 64296-25-9
• SMILES: [C@@]123N(CCC1(O)O)C(=N[C@H]([C@@H]2NC(=N3)N)COC(=O)N[S](O)(=O)=O)N
• InChI: 1S/C10H17N7O7S/c11-6-14-5-4(3-24-8(18)16-25(21,22)23)13-7(12)17-2-1-9(19,20)10(5,17)15-6/h4-5,19-20H,1-3H2,(H2,12,13)(H,16,18)(H3,11,14,15)(H,21,22,23)/t4-,5-,10-/m0/s1
• InChIKey: JKKCSFJSULZNDN-HGRQIUPRSA-N

Properties

• Density: 2.402g/cm³ (Cal.)