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ethyl (2R,3R)-2-octadecanoylamino-3-hydroxyoctadecanoate

HCID 86638488
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCCCCCCCCCCCCCCCC(=O)N[C@@H](C(=O)OCC)[C@H](O)CCCCCCCCCCCCCCC
InChIKey
AYSWMGYACNNHQK-ZEEKBPLESA-N
Molecular formula
C38H75NO4
Average molar mass
610 g/mol

Names & identifiers

Preferred name
ethyl (2R,3R)-2-octadecanoylamino-3-hydroxyoctadecanoate
IUPAC
ethyl (2R,3R)-3-hydroxy-2-(octadecanoylamino)octadecanoate

Names & synonyms

AYSWMGYACNNHQK-ZEEKBPLESA-Nethyl (2R,3R)-2-octadecanoylamino-3-hydroxyoctadecanoate

Database identifiers

PubChem CID
86638488

Properties

Computed structural properties

XLogP
15.4
Topological polar surface area
75.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
35
Heavy atoms
43
Formal charge
0
Complexity
596

Related reactions

6 records
New reaction record
HRID 222834 reaction equation
HRID 222834As productuspto-grants-2012_06
HRID 222835 reaction equation
HRID 222835As productuspto-grants-2012_06
HRID 222837 reaction equation
HRID 222837As reactantuspto-grants-2012_06
HRID 222839 reaction equation
HRID 222839As reactantuspto-grants-2012_06
HRID 222840 reaction equation
HRID 222840As reactantuspto-grants-2012_06
HRID 222841 reaction equation
HRID 222841As reactantuspto-grants-2012_06

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes