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Decarbamoylneosaxitoxin

PropertiesImageOccurences in reactions
MNX_IDMNXM124243Image of MNXM124243
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC9H16N6O4
charge0
mass272.1233
referencechebi:174589
InChIKeyKUMXVBFFVVLQFX-PJPYAQQDSA-N
InChIInChI=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
SMILESN=C1N(O)[C@@H](CO)[C@@H]2N=C(N)N[C@]23N1CCC3(O)O
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Similar chemical compounds in external resources
IdentifierDescription
CHEBI:174589
chebi:174589 		Decarbamoylneosaxitoxin
(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
hmdb:HMDB0033663 Decarbamoylneosaxitoxin
4-(hydroxymethyl)-2,6-diimino-decahydropyrrolo[1,2-c]purine-5,10,10-triol
4-(hydroxymethyl)-2,6-diimino-hexahydropyrrolo[1,2-c]purine-5,10,10-triol
hmdb:HMDB33663 secondary/obsolete/fantasy identifier