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(Q105128932)
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English
3-Oxo-4alpha-isobutyl-3,4-dihydro1H-pyrrolo[2,1-c][1,4]oxazine-6-carbaldehyde
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
alkaloid
0 references
mass
221.10519334
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₅NO₃
0 references
canonical SMILES
O=CC1=CC=C2N1C(C(=O)OC2)CC(C)C
0 references
isomeric SMILES
CC(C)C[C@H]1C(=O)OCc2ccc(C=O)n21
0 references
found in taxon
Streptomyces albospinus
1 reference
stated in
Expanding the Chemical Repertoire of the Endophyte Streptomyces albospinus RLe7 Reveals Amphotericin B as an Inducer of a Fungal Phenotype.
Jishengella endophytica
1 reference
stated in
Alkaloids from the mangrove-derived actinomycete Jishengella endophytica 161111.
Identifiers
InChI
InChI=1S/C12H15NO3/c1-8(2)5-11-12(15)16-7-10-4-3-9(6-14)13(10)11/h3-4,6,8,11H,5,7H2,1-2H3/t11-/m0/s1
0 references
InChIKey
JIDALDBSXBQUJI-NSHDSACASA-N
0 references
PubChem CID
132594744
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JIDALDBSXBQUJI-NSHDSACASA-N
ChEBI ID
218452
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C12H15NO3/c1-8(2)5-11-12(15)16-7-10-4-3-9(6-14)13(10)11/h3-4,6,8,11H,5,7H2,1-2H3/t11-/m0/s1
UniChem compound ID
153954890
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA032479
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
JIDALDBSXBQUJI-NSHDSACASA-N
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