11-azanyl-N-[(2S)-1-[[(2S)-6-azanyl-1-(3-cyclooctylpropylamino)-1-oxidanylidene-hexan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]undecanamide

Systemtic Name: 11-azanyl-N-[(2S)-1-[[(2S)-6-azanyl-1-(3-cyclooctylpropylamino)-1-oxidanylidene-hexan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]undecanamide Openeye Name: 11-amino-N-[(1S)-2-[[(1S)-5-amino-1-(3-cyclooctylpropylcarbamoyl)pentyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]undecanamide CAS Name: 11-amino-N-[(2S)-1-[[(2S)-6-amino-1-(3-cyclooctylpropylamino)-1-oxohexan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]undecanamide IUPAC Name: 11-amino-N-[(2S)-1-[[(2S)-6-amino-1-(3-cyclooctylpropylamino)-1-oxohexan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]undecanamide Traditional Name: 11-amino-N-[(1S)-2-[[(1S)-5-amino-1-(3-cyclooctylpropylcarbamoyl)pentyl]amino]-2-keto-1-methylol-ethyl]undecanamide Formula: C31H61N5O4 MolecularWeight: 567.84714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)CCCNC(=O)C(CCCCN)NC(=O)C(CO)NC(=O)CCCCCCCCCCN

Isomeric SMILES

C1CCCC(CCC1)CCCNC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CCCCCCCCCCN

InChI

InChI=1S/C31H61N5O4/c32-22-14-9-4-2-1-3-8-12-21-29(38)35-28(25-37)31(40)36-27(20-13-15-23-33)30(39)34-24-16-19-26-17-10-6-5-7-11-18-26/h26-28,37H,1-25,32-33H2,(H,34,39)(H,35,38)(H,36,40)/t27-,28-/m0/s1