4-oxidanylidene-3-[[2-(pentadecanoylamino)-3-phenyl-propanoyl]amino]pentanoic acid

Systemtic Name: 4-oxidanylidene-3-[[2-(pentadecanoylamino)-3-phenyl-propanoyl]amino]pentanoic acid Openeye Name: 4-oxo-3-[[2-(pentadecanoylamino)-3-phenyl-propanoyl]amino]pentanoic acid CAS Name: 4-oxo-3-[[1-oxo-2-(1-oxopentadecylamino)-3-phenylpropyl]amino]pentanoic acid IUPAC Name: 4-oxo-3-[[2-(pentadecanoylamino)-3-phenylpropanoyl]amino]pentanoic acid Traditional Name: 4-keto-3-[[2-(pentadecanoylamino)-3-phenyl-propanoyl]amino]valeric acid Formula: C29H46N2O5 MolecularWeight: 502.68594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC(=O)O)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC(=O)O)C(=O)C

InChI

InChI=1S/C29H46N2O5/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-27(33)30-26(21-24-18-15-14-16-19-24)29(36)31-25(23(2)32)22-28(34)35/h14-16,18-19,25-26H,3-13,17,20-22H2,1-2H3,(H,30,33)(H,31,36)(H,34,35)