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(Q63390534)
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English
L-Rhamnitol
chemical compound
1-deoxy-L-mannitol
In more languages
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Statements
instance of
type of chemical entity
0 references
subclass of
hexane-1,2,3,4,5-pentol
1 reference
based on heuristic
identical core structure
hexitol
0 references
mass
166.084123548
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
1-Deoxyhexitol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
D-fucitol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
L-fucitol
1 reference
based on heuristic
inferred from InChI
6-Deoxy-L-glucitol
1 reference
based on heuristic
inferred from InChI
(2S,3R,4R,5R)-hexane-1,2,3,4,5-pentol
1 reference
based on heuristic
inferred from InChI
(2R,3R,4R,5S)-hexane-1,2,3,4,5-pentol
1 reference
based on heuristic
inferred from InChI
6-deoxyaltritol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₆H₁₄O₅
0 references
canonical SMILES
CC(C(C(C(CO)O)O)O)O
1 reference
stated in
RCSB protein data bank
PDB ligand ID
RNT
language of work or name
English
retrieved
16 February 2021
isomeric SMILES
C[C@@H]([C@@H]([C@H]([C@H](CO)O)O)O)O
0 references
found in taxon
Malus
2 references
stated in
Integrated Analytical and Statistical Two-Dimensional Spectroscopy Strategy for Metabolite Identification: Application to Dietary Biomarkers.
stated in
A NMR-based, non-targeted multistep metabolic profiling revealed L-rhamnitol as a metabolite that characterised apples from different geographic origins
Identifiers
InChI
InChI=1S/C6H14O5/c1-3(8)5(10)6(11)4(9)2-7/h3-11H,2H2,1H3/t3-,4-,5-,6-/m0/s1
0 references
InChIKey
SKCKOFZKJLZSFA-BXKVDMCESA-N
1 reference
stated in
ChEBI release 2020-09-01
PubChem CID
445052
1 reference
matched by identifier from
InChIKey
InChIKey
SKCKOFZKJLZSFA-BXKVDMCESA-N
ChEBI ID
45530
mapping relation type
exact match
2 references
stated in
ChEBI release 2019-10-02
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C6H14O5/c1-3(8)5(10)6(11)4(9)2-7/h3-11H,2H2,1H3/t3-,4-,5-,6-/m0/s1
UniChem compound ID
637198
1 reference
stated in
UniChem
DrugBank ID
DB02399
1 reference
matched by identifier from
InChIKey
InChIKey
SKCKOFZKJLZSFA-BXKVDMCESA-N
Human Metabolome Database ID
HMDB0240555
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SKCKOFZKJLZSFA-BXKVDMCESA-N
UNII
IHI9UGC58P
1 reference
matched by identifier from
InChIKey
InChIKey
SKCKOFZKJLZSFA-BXKVDMCESA-N
Probes And Drugs ID
PD060061
0 references
PDB ligand ID
RNT
0 references
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