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(Q82072173)
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English
2-[6-(Benzylamino)purin-7-yl]-6-(hydroxymethyl)oxane-3,4,5-triol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
387.154268772
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₁N₅O₅
0 references
canonical SMILES
OCC1OC(N2C=NC=3N=CN=C(NCC=4C=CC=CC4)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/C18H21N5O5/c24-7-11-13(25)14(26)15(27)18(28-11)23-9-22-17-12(23)16(20-8-21-17)19-6-10-4-2-1-3-5-10/h1-5,8-9,11,13-15,18,24-27H,6-7H2,(H,19,20,21)
0 references
InChIKey
MFMRRPHRZQYKIJ-UHFFFAOYSA-N
0 references
CAS Registry Number
56159-42-3
0 references
PubChem CID
330021
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
MFMRRPHRZQYKIJ-UHFFFAOYSA-N
UniChem compound ID
43065404
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80317426
1 reference
matched by identifier from
InChIKey
InChIKey
MFMRRPHRZQYKIJ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20268549
0 references
NSC number
315504
0 references
KNApSAcK ID
C00062221
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MFMRRPHRZQYKIJ-UHFFFAOYSA-N
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