(3aS,10aS)-3aα,4,9,10-Tetrahydro-2,6-diamino-4α-[[(sulfoaminocarbonyl)oxy]methyl]-1H,8H-pyrrolo[1,2-c]purine-9β,10,10-triol 9-sulfate

Base Information

• Chemical Name: (3aS,10aS)-3aα,4,9,10-Tetrahydro-2,6-diamino-4α-[[(sulfoaminocarbonyl)oxy]methyl]-1H,8H-pyrrolo[1,2-c]purine-9β,10,10-triol 9-sulfate
• CAS No.: 80173-30-4
• Molecular Formula: C₁₀H₁₇N₇O₁₁S₂
• Molecular Weight: 475.417
• Mol file: 80173-30-4.mol

Synonyms:Protogonyautoxin-1;21-sulfo-11α-hydroxysaxitoxin sulfate;C1;

Chemical Property of (3aS,10aS)-3aα,4,9,10-Tetrahydro-2,6-diamino-4α-[[(sulfoaminocarbonyl)oxy]methyl]-1H,8H-pyrrolo[1,2-c]purine-9β,10,10-triol 9-sulfate

Chemical Property:

• PKA: -3.88±0.18(Predicted)
• PSA: 300.55000
• Density: 2.61g/cm³
• LogP: -1.52480

Purity/Quality:

99% ^*data from raw suppliers

N-Sulfocarbamoylgonyautoxin-2 and -3 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: N-Sulfocarbamoylgonyautoxin 2 is a paralytic shellfish toxins. C1. EU regulated marine toxin.

Technology Process of (3aS,10aS)-3aα,4,9,10-Tetrahydro-2,6-diamino-4α-[[(sulfoaminocarbonyl)oxy]methyl]-1H,8H-pyrrolo[1,2-c]purine-9β,10,10-triol 9-sulfate

There total 2 articles about (3aS,10aS)-3aα,4,9,10-Tetrahydro-2,6-diamino-4α-[[(sulfoaminocarbonyl)oxy]methyl]-1H,8H-pyrrolo[1,2-c]purine-9β,10,10-triol 9-sulfate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

gonyautoxin VIII (80173-30-4,80226-62-6) → C10H17N7O11S2 (80173-30-4,80226-62-6)

Guidance literature:

In water; at 37 ℃; for 72h;

DOI:10.1016/0040-4020(84)85059-0

Reference yield:

C10H17N7O11S2 (80173-30-4,80226-62-6) → gonyautoxin VIII (80173-30-4,80226-62-6)

Guidance literature:

Equilibrium constant;

DOI:10.1016/0040-4020(84)85059-0

Reference yield:

gonyautoxin VIII (80173-30-4,80226-62-6) → C10H17N7O11S2 (80173-30-4,80226-62-6)

Guidance literature:

In water; at 37 ℃; for 72h;

DOI:10.1016/0040-4020(84)85059-0

upstream raw materials:

gonyautoxin VIII

C₁₀H₁₇N₇O₁₁S₂

Downstream raw materials:

gonyautoxin VIII

C₁₀H₁₇N₇O₁₁S₂

Refernces

• 1、 Kobayashi, Masaru,Shimizu, Yuzuru. "Gonyautoxin VIII, a Cryptic Precursor of Paralytic Shellfish Poisons". . p. 827 - 828. Retrieved 1981.