(2S)-N-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-2-[2-[[(2S)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]amino]ethoxy]-4,5-bis(oxidanyl)oxan-3-yl]-2,6-bis(azanyl)hexanamide

Systemtic Name: (2S)-N-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-2-[2-[[(2S)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]amino]ethoxy]-4,5-bis(oxidanyl)oxan-3-yl]-2,6-bis(azanyl)hexanamide Openeye Name: (2S)-2,6-diamino-N-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-2-[2-[[(1S)-1-carbamoyl-3-methyl-butyl]amino]ethoxy]-4,5-dihydroxy-tetrahydropyran-3-yl]hexanamide CAS Name: (2S)-2,6-diamino-N-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-2-[2-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]amino]ethoxy]-4,5-dihydroxy-3-oxanyl]hexanamide IUPAC Name: (2S)-2,6-diamino-N-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-2-[2-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]amino]ethoxy]-4,5-dihydroxyoxan-3-yl]hexanamide Traditional Name: (2S)-2,6-diamino-N-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-2-[2-[[(1S)-1-carbamoyl-3-methyl-butyl]amino]ethoxy]-4,5-dihydroxy-tetrahydropyran-3-yl]hexanamide Formula: C20H42N6O6 MolecularWeight: 462.58408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NCCOC1C(C(C(C(O1)CN)O)O)NC(=O)C(CCCCN)N

Isomeric SMILES

CC(C)C[C@@H](C(=O)N)NCCO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CN)O)O)NC(=O)[C@H](CCCCN)N

InChI

InChI=1S/C20H42N6O6/c1-11(2)9-13(18(24)29)25-7-8-31-20-15(17(28)16(27)14(10-22)32-20)26-19(30)12(23)5-3-4-6-21/h11-17,20,25,27-28H,3-10,21-23H2,1-2H3,(H2,24,29)(H,26,30)/t12-,13-,14+,15+,16+,17+,20-/m0/s1