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(Q110185022)
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Isopentenyl-Adenine-9-glucoside
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-(hydroxymethyl)-6-{6-[(3-methylbut-2-en-1-yl)amino]purin-9-yl}oxane-3,4,5-triol
1 reference
based on heuristic
inferred from SMILES
mass
365.169918836
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
9-(alpha-D-glucosyl)-N(6)-isopentenyladenine
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(2S,3S,4R,5S,6R)-2-(hydroxymethyl)-6-[6-(3-methylbut-2-enylamino)purin-9-yl]oxane-3,4,5-triol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₆H₂₃N₅O₅
0 references
canonical SMILES
OCC1OC(N2C=NC=3C(=NC=NC32)NCC=C(C)C)C(O)C(O)C1O
0 references
isomeric SMILES
CC(C)=CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
0 references
found in taxon
sweet potato
1 reference
stated in
Mass spectrometric determination of cytokinins in young sweet-potato plants using deuterium-labeled standards.
Identifiers
InChI
InChI=1S/C16H23N5O5/c1-8(2)3-4-17-14-10-15(19-6-18-14)21(7-20-10)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)/t9-,11-,12+,13-,16-/m1/s1
0 references
InChIKey
XEHLLUQVSRLWMH-HDNYONAXSA-N
0 references
PubChem CID
11675006
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XEHLLUQVSRLWMH-HDNYONAXSA-N
UniChem compound ID
34338957
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-MPI_for_Chemical_Ecology-CE000237
1 reference
InChIKey
XEHLLUQVSRLWMH-HDNYONAXSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-MPI_for_Chemical_Ecology-CE000604
1 reference
InChIKey
XEHLLUQVSRLWMH-HDNYONAXSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR020122
1 reference
InChIKey
XEHLLUQVSRLWMH-HDNYONAXSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR020123
1 reference
InChIKey
XEHLLUQVSRLWMH-HDNYONAXSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN-PR020124
1 reference
InChIKey
XEHLLUQVSRLWMH-HDNYONAXSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
DSSTox substance ID
DTXSID001345639
1 reference
matched by identifier from
InChIKey
InChIKey
XEHLLUQVSRLWMH-HDNYONAXSA-N
Cannabis Database ID
005019
1 reference
stated in
Cannabis Database
Human Metabolome Database ID
HMDB0012240
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XEHLLUQVSRLWMH-HDNYONAXSA-N
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