[(2S)-2,5-bis(3-azanylpropylamino)pentanoyl] (2S)-5-azanyl-2-(didodecylamino)-5-oxidanylidene-pentanoate

Systemtic Name: [(2S)-2,5-bis(3-azanylpropylamino)pentanoyl] (2S)-5-azanyl-2-(didodecylamino)-5-oxidanylidene-pentanoate Openeye Name: [(2S)-2,5-bis(3-aminopropylamino)pentanoyl] (2S)-5-amino-2-(didodecylamino)-5-oxo-pentanoate CAS Name: (2S)-5-amino-2-(didodecylamino)-5-oxopentanoic acid [(2S)-2,5-bis(3-aminopropylamino)-1-oxopentyl] ester IUPAC Name: [(2S)-2,5-bis(3-aminopropylamino)pentanoyl] (2S)-5-amino-2-(didodecylamino)-5-oxopentanoate Traditional Name: (2S)-5-amino-2-(dilaurylamino)-5-keto-valeric acid [(2S)-2,5-bis(3-aminopropylamino)pentanoyl] ester Formula: C40H82N6O4 MolecularWeight: 711.11688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(CCCCCCCCCCCC)C(CCC(=O)N)C(=O)OC(=O)C(CCCNCCCN)NCCCN

Isomeric SMILES

CCCCCCCCCCCCN(CCCCCCCCCCCC)[C@@H](CCC(=O)N)C(=O)OC(=O)[C@H](CCCNCCCN)NCCCN

InChI

InChI=1S/C40H82N6O4/c1-3-5-7-9-11-13-15-17-19-21-34-46(35-22-20-18-16-14-12-10-8-6-4-2)37(27-28-38(43)47)40(49)50-39(48)36(45-33-25-30-42)26-23-31-44-32-24-29-41/h36-37,44-45H,3-35,41-42H2,1-2H3,(H2,43,47)/t36-,37-/m0/s1