Decarbamoylneosaxitoxin

• CAT Number: T000005
• CAS Number: 68683-58-9
• Molecular Formula: C9 H16 N6 O4
• Molecular Weight: 272.26
• Purity: ≥95%
• Synonyms: Decarbamoylneosaxitoxin; 1-Hydroxydecarbamoylsaxitoxin
• Storage: -20°C
• IUPAC Name: (3aS,4R,10aS)-2-amino-5-hydroxy-4-(hydroxymethyl)-6-imino-3a,4,8,9-tetrahydro-1H-pyrrolo[1,2-c]purine-10,10-diol
• InChI: InChI=1S/C9H16N6O4/c10-6-12-5-4(3-16)15(19)7(11)14-2-1-8(17,18)9(5,14)13-6/h4-5,11,16-19H,1-3H2,(H3,10,12,13)/t4-,5-,9-/m0/s1
• InChIKey: KUMXVBFFVVLQFX-PJPYAQQDSA-N
• SMILES: C1CN2C(=N)N(C(C3C2(C1(O)O)NC(=N3)N)CO)O

Decarbamoylneosaxitoxin (CAS 68683-58-9) is one of the derivatives from saxitoxin. 

Reference

1.Munday, Rex, et al. "Acute toxicities of saxitoxin, neosaxitoxin, decarbamoyl saxitoxin and gonyautoxins 1&4 and 2&3 to mice by various routes of administration." Toxicon 76 (2013): 77-83.