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(Q82072174)
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NSC315506
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
365.169918836
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₂₃N₅O₅
0 references
canonical SMILES
OCC1OC(N2C=NC=3N=CN=C(NCC=C(C)C)C32)C(O)C(O)C1O
0 references
found in taxon
tomato
1 reference
stated in
Ultra-high performance liquid chromatography coupled to high resolution Orbitrap mass spectrometry for metabolomic profiling of the endogenous phytohormonal status of the tomato plant.
Identifiers
InChI
InChI=1S/C16H23N5O5/c1-8(2)3-4-17-14-10-15(19-6-18-14)20-7-21(10)16-13(25)12(24)11(23)9(5-22)26-16/h3,6-7,9,11-13,16,22-25H,4-5H2,1-2H3,(H,17,18,19)
0 references
InChIKey
ORUWKZNXHJIZKV-UHFFFAOYSA-N
0 references
CAS Registry Number
59384-58-6
0 references
PubChem CID
330023
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
ORUWKZNXHJIZKV-UHFFFAOYSA-N
UniChem compound ID
48037755
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-MPI_for_Chemical_Ecology-CE000239
0 references
DSSTox substance ID
DTXSID40317427
0 references
DSSTOX compound identifier
DTXCID30268550
0 references
NSC number
315506
0 references
KNApSAcK ID
C00062360
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ORUWKZNXHJIZKV-UHFFFAOYSA-N
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