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5-azanyl-2-(3-octadecanoyloxyoctadecanoylamino)pentanoic acid

5-azanyl-2-(3-octadecanoyloxyoctadecanoylamino)pentanoic acid

Systemtic Name:5-azanyl-2-(3-octadecanoyloxyoctadecanoylamino)pentanoic acid
Openeye Name:5-amino-2-(3-octadecanoyloxyoctadecanoylamino)pentanoic acid
CAS Name:5-amino-2-[[1-oxo-3-(1-oxooctadecoxy)octadecyl]amino]pentanoic acid
IUPAC Name:5-amino-2-(3-octadecanoyloxyoctadecanoylamino)pentanoic acid
Traditional Name:5-amino-2-(3-stearoyloxyoctadecanoylamino)valeric acid
Formula: C41H80N2O5
MolecularWeight: 681.0843
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCCCCC)CC(=O)NC(CCCN)C(=O)O


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(CCCCCCCCCCCCCCC)CC(=O)NC(CCCN)C(=O)O


InChI

InChI=1S/C41H80N2O5/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-34-40(45)48-37(36-39(44)43-38(41(46)47)33-31-35-42)32-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h37-38H,3-36,42H2,1-2H3,(H,43,44)(H,46,47)


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