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CHEBI:40989 - (1S,7S)-7-amino-7-methyl-8-oxohexahydro-1H-pyrazolo[1,2-a]pyridazine-1-carbaldehyde

ChEBI IDCHEBI:40989
ChEBI Name(1S,7S)-7-amino-7-methyl-8-oxohexahydro-1H-pyrazolo[1,2-a]pyridazine-1-carbaldehyde
Stars
ASCII Name(1S,7S)-7-amino-7-methyl-8-oxohexahydro-1H-pyrazolo[1,2-a]pyridazine-1-carbaldehyde
Last Modified30 January 2008
DownloadsMolfile
FormulaC9H15N3O2
Net Charge0
Average Mass197.238
Monoisotopic Mass197.11643
SMILES[H]C(=O)[C@@]1([H])N2C(=O)[C@](N([H])[H])(C([H])([H])[H])C([H])([H])C([H])([H])N2C([H])([H])C1([H])[H]
InChIInChI=1S/C9H15N3O2/c1-9(10)3-5-11-4-2-7(6-13)12(11)8(9)14/h6-7H,2-5,10H2,1H3/t7-,9-/m0/s1
InChIKeyDBXOZYHJFAKQPU-CBAPKCEASA-N
ChEBI Ontology
Outgoing Relation(s)
(1S,7S)-7-amino-7-methyl-8-oxohexahydro-1H-pyrazolo[1,2-a]pyridazine-1-carbaldehyde (CHEBI:40989) is a aldehyde (CHEBI:17478)
(1S,7S)-7-amino-7-methyl-8-oxohexahydro-1H-pyrazolo[1,2-a]pyridazine-1-carbaldehyde (CHEBI:40989) is a pyrazolopyridazine (CHEBI:48383)
Synonym  Source
(1S,7S)-7-amino-7-methyl-8-oxohexahydro-1H-pyrazolo[1,2-a]pyridazine-1-carbaldehydePDBeChem
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BCYPDBeChem