(2R)-2-[[(2S)-2-azanylpropanoyl]-octadecan-3-yl-amino]pentanedioic acid

Systemtic Name: (2R)-2-[[(2S)-2-azanylpropanoyl]-octadecan-3-yl-amino]pentanedioic acid Openeye Name: (2R)-2-[[(2S)-2-aminopropanoyl]-(1-ethylhexadecyl)amino]pentanedioic acid CAS Name: (2R)-2-[[(2S)-2-amino-1-oxopropyl]-octadecan-3-ylamino]pentanedioic acid IUPAC Name: (2R)-2-[[(2S)-2-aminopropanoyl]-octadecan-3-ylamino]pentanedioic acid Traditional Name: (2R)-2-[[(2S)-2-aminopropanoyl]-(1-ethylhexadecyl)amino]glutaric acid Formula: C26H50N2O5 MolecularWeight: 470.6856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CC)N(C(CCC(=O)O)C(=O)O)C(=O)C(C)N

Isomeric SMILES

CCCCCCCCCCCCCCCC(CC)N([C@H](CCC(=O)O)C(=O)O)C(=O)[C@H](C)N

InChI

InChI=1S/C26H50N2O5/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-22(5-2)28(25(31)21(3)27)23(26(32)33)19-20-24(29)30/h21-23H,4-20,27H2,1-3H3,(H,29,30)(H,32,33)/t21-,22?,23+/m0/s1