5-azanyl-2-[[2-(octadecylamino)-3-oxidanyl-butanoyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[[2-(octadecylamino)-3-oxidanyl-butanoyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[[3-hydroxy-2-(octadecylamino)butanoyl]amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[3-hydroxy-2-(octadecylamino)-1-oxobutyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[[3-hydroxy-2-(octadecylamino)butanoyl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[[3-hydroxy-2-(stearylamino)butanoyl]amino]-5-keto-valeric acid Formula: C27H53N3O5 MolecularWeight: 499.72682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(C(C)O)C(=O)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(C(C)O)C(=O)NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C27H53N3O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-29-25(22(2)31)26(33)30-23(27(34)35)19-20-24(28)32/h22-23,25,29,31H,3-21H2,1-2H3,(H2,28,32)(H,30,33)(H,34,35)