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(Q105158762)
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English
N-(2R-Hydroxytricosanoyl)-2S-amino-1,3S,4R-octadecanetriol
group of stereoisomers with the chemical formula C₄₁H₈₃NO₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
fatty acid amide
1 reference
inferred from
fatty acid amide
mass
669.6271247560002
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₄₁H₈₃NO₅
0 references
canonical SMILES
CCCCCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC
0 references
Identifiers
InChI
InChI=1S/C41H83NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-39(45)41(47)42-37(36-43)40(46)38(44)34-32-30-28-26-24-16-14-12-10-8-6-4-2/h37-40,43-46H,3-36H2,1-2H3,(H,42,47)
0 references
InChIKey
LXCDJSOYWPJYDC-UHFFFAOYSA-N
0 references
PubChem CID
25200791
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
LXCDJSOYWPJYDC-UHFFFAOYSA-N
UniChem compound ID
32021579
1 reference
stated in
UniChem
MassBank accession ID
MSBNK-RIKEN_IMS-LQB00005
1 reference
InChIKey
LXCDJSOYWPJYDC-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
MSBNK-RIKEN_IMS-LQB00391
1 reference
InChIKey
LXCDJSOYWPJYDC-UHFFFAOYSA-N
stated in
MassBank/MassBank-data: release version 2022.06 to wikidata
retrieved
4 September 2022
based on heuristic
InChIKey match
Human Metabolome Database ID
HMDB0035470
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LXCDJSOYWPJYDC-UHFFFAOYSA-N
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