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(Q82006681)
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English
(2-hexadecanoyloxy-3-hydroxypropyl) octadecanoate
chemical compound
2-(Hexadecanoyloxy)-3-hydroxypropyl octadecanoate
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
596.5379754039999
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₇H₇₂O₅
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCCC
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C37H72O5/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-36(39)41-34-35(33-38)42-37(40)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h35,38H,3-34H2,1-2H3
0 references
InChIKey
VYQDALBEQRZDPL-UHFFFAOYSA-N
0 references
CAS Registry Number
14015-55-5
reason for deprecated rank
cannot be confirmed by other sources
0 references
29593-61-1
0 references
PubChem CID
122421
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
26987803
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10276259
0 references
DTXSID40952074
0 references
DSSTOX compound identifier
DTXCID90227582
0 references
DTXCID10876470
0 references
Probes And Drugs ID
PD085545
0 references
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