ethyl (2S)-5-azanyl-2-[[(2S)-5-azanyl-2-(hexadecanoylamino)pentanoyl]amino]pentanoate dihydrochloride

Systemtic Name: ethyl (2S)-5-azanyl-2-[[(2S)-5-azanyl-2-(hexadecanoylamino)pentanoyl]amino]pentanoate dihydrochloride Openeye Name: ethyl (2S)-5-amino-2-[[(2S)-5-amino-2-(hexadecanoylamino)pentanoyl]amino]pentanoate dihydrochloride CAS Name: (2S)-5-amino-2-[[(2S)-5-amino-1-oxo-2-(1-oxohexadecylamino)pentyl]amino]pentanoic acid ethyl ester dihydrochloride IUPAC Name: ethyl (2S)-5-amino-2-[[(2S)-5-amino-2-(hexadecanoylamino)pentanoyl]amino]pentanoate dihydrochloride Traditional Name: (2S)-5-amino-2-[[(2S)-5-amino-2-palmitamido-pentanoyl]amino]valeric acid ethyl ester dihydrochloride Formula: C28H58Cl2N4O4 MolecularWeight: 585.69052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CCCN)C(=O)NC(CCCN)C(=O)OCC.Cl.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N[C@@H](CCCN)C(=O)N[C@@H](CCCN)C(=O)OCC.Cl.Cl

InChI

InChI=1S/C28H56N4O4.2ClH/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-21-26(33)31-24(19-17-22-29)27(34)32-25(20-18-23-30)28(35)36-4-2;;/h24-25H,3-23,29-30H2,1-2H3,(H,31,33)(H,32,34);2*1H/t24-,25-;;/m0../s1