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(Q82529071)
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Tridecyl docosanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic acyclic ester
0 references
mass
522.53758148
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₅H₇₀O₂
0 references
canonical SMILES
O=C(OCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCC
0 references
found in taxon
Artocarpus integer
1 reference
stated in
Flavonoids and 9-hydroxytridecyl docosanoate from Artocarpus heterophyllus
Identifiers
InChI
InChI=1S/C35H70O2/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-25-27-29-31-33-35(36)37-34-32-30-28-26-24-14-12-10-8-6-4-2/h3-34H2,1-2H3
0 references
InChIKey
VBCBSDJKFLGBIX-UHFFFAOYSA-N
0 references
CAS Registry Number
42233-08-9
0 references
PubChem CID
22287906
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
SureChEMBL ID
SCHEMBL236962
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VBCBSDJKFLGBIX-UHFFFAOYSA-N
UniChem compound ID
25781657
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40624401
0 references
DSSTOX compound identifier
DTXCID70575154
0 references
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