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Substance Name: 6-Epitetrodotoxin
RN: 112318-40-8
InChIKey: CFMYXEVWODSLAX-YPXFGVONSA-N

Note

  • C6--OH in epimeric position.

Molecular Weight

  • 319.268
 
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Names and Synonyms

Name of Substance

  • 6-Epitetrodotoxin

Systematic Name

  • Tetrodotoxin, (6beta)-

Registry Numbers

CAS Registry Number

  • 112318-40-8

System Generated Number

  • 0112318408

Structure Descriptors

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

InChIKey

CFMYXEVWODSLAX-YPXFGVONSA-N

Smiles

O1[C@@H]2[C@](CO)(O)[C@@H]3O[C@]1([C@H]([C@]1([C@@H]3[C@@H](O)N=C(N)N1)[C@@H]2O)O)O