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(Q82726981)
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Pentacosyl docosanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic acyclic ester
0 references
mass
690.725382248
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₄₇H₉₄O₂
0 references
canonical SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCCCCCC
0 references
found in taxon
Chlorophytum arundinaceum
1 reference
stated in
4-hydroxy-8,11-oxidoheneicosanol and other constituents from Chlorophytum arundinaceum roots
Identifiers
InChI
InChI=1S/C47H94O2/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-28-30-32-34-36-38-40-42-44-46-49-47(48)45-43-41-39-37-35-33-31-29-27-22-20-18-16-14-12-10-8-6-4-2/h3-46H2,1-2H3
0 references
InChIKey
HSXVHAPZNKZODX-UHFFFAOYSA-N
0 references
CAS Registry Number
137732-44-6
1 reference
InChIKey
HSXVHAPZNKZODX-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
9 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=137732-44-6
PubChem CID
71341705
1 reference
matched by identifier from
InChIKey
InChIKey
HSXVHAPZNKZODX-UHFFFAOYSA-N
UniChem compound ID
49415476
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60768578
1 reference
matched by identifier from
InChIKey
InChIKey
HSXVHAPZNKZODX-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID40719321
0 references
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