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hexadecyl (2S)-2-(docosanoylamino)-3-oxidanyl-propanoate

hexadecyl (2S)-2-(docosanoylamino)-3-oxidanyl-propanoate

Systemtic Name:hexadecyl (2S)-2-(docosanoylamino)-3-oxidanyl-propanoate
Openeye Name:hexadecyl (2S)-2-(docosanoylamino)-3-hydroxy-propanoate
CAS Name:(2S)-3-hydroxy-2-(1-oxodocosylamino)propanoic acid hexadecyl ester
IUPAC Name:hexadecyl (2S)-2-(docosanoylamino)-3-hydroxypropanoate
Traditional Name:(2S)-2-(docosanoylamino)-3-hydroxy-propionic acid cetyl ester
Formula: C41H81NO4
MolecularWeight: 652.08614
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(=O)OCCCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)OCCCCCCCCCCCCCCCC


InChI

InChI=1S/C41H81NO4/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-40(44)42-39(38-43)41(45)46-37-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h39,43H,3-38H2,1-2H3,(H,42,44)/t39-/m0/s1


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