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(Q104887593)
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English
[10-[(2,4-dioxo-1H-pyrimidin-6-yl)-hydroxymethyl]-5-methyl-2,11,12-triazatricyclo[6.3.1.04,12]dodec-1-en-6-yl] hydrogen sulfate
group of stereoisomers with the chemical formula C₁₅H₂₁N₅O₇S
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Statements
instance of
group of stereoisomers
0 references
subclass of
pyrimidine
1 reference
inferred from
pyrimidine
mass
415.116169012
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₁N₅O₇S
0 references
canonical SMILES
O=C1C=C(N=C(O)N1)C(O)C2NC3=NCC4N3C(CC(OS(=O)(=O)O)C4C)C2
0 references
found in taxon
Chrysosporum ovalisporum
1 reference
stated in
Cylindrospermopsin induces neurotoxicity in tilapia fish (Oreochromis niloticus) exposed to Aphanizomenon ovalisporum
Identifiers
InChI
InChI=1S/C15H21N5O7S/c1-6-10-5-16-14-17-8(13(22)9-4-12(21)19-15(23)18-9)2-7(20(10)14)3-11(6)27-28(24,25)26/h4,6-8,10-11,13,22H,2-3,5H2,1H3,(H,16,17)(H,24,25,26)(H2,18,19,21,23)
0 references
InChIKey
LHJPHMKIGRLKDR-UHFFFAOYSA-N
0 references
PubChem CID
45934427
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
LHJPHMKIGRLKDR-UHFFFAOYSA-N
UniChem compound ID
53678303
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0247246
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LHJPHMKIGRLKDR-UHFFFAOYSA-N
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