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Decarbamoylsaxitoxin - CAS 58911-04-9


Decarbamoylsaxitoxin (CAS 58911-04-9), abbreviated as dcSTX, is a neurotoxin which is naturally produced in dinoflagellate. DcSTX is one of the many analogues of saxitoxin. Saxitoxin is a tricyclic alkaloid compound, which has multiple structural related neurotoxins.

Catalog Number: T000006

CAS Number: 58911-04-9

PubChem Substance ID:355159369

Molecular Formula: C9H16N6O3

Molecular Weight:256.266

Purity: ≥95%

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Synonym

SynonymsDecarbamoylsaxitoxin; Decarbamylsaxitoxin; Descarbamoylsaxitoxin

Property

Molecular Formula: C9H16N6O3
Molecular Weight256.266
Purity≥95%
Storage-20°C

Computed Descriptor

IUPAC Name(3aS,4R,10aS)-2,6-diamino-4-(hydroxymethyl)-3a,4,8,9-tetrahydro-3H-pyrrolo[1,2-c]purine-10,10-diol
InChIInChI=1S/C9H16N6O3/c10-6-13-5-4(3-16)12-7(11)15-2-1-8(17,18)9(5,15)14-6/h4-5,16-18H,1-3H2,(H2,11,12)(H3,10,13,14)/t4-,5-,9-/m0/s1
InChIKeyVRRIYZJUSNMZMP-PJPYAQQDSA-N
SMILESC1CN2C(=NC(C3C2(C1(O)O)N=C(N3)N)CO)N