(2S)-N-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-2-[2-[(2-azanyl-2-oxidanylidene-ethyl)amino]ethoxy]-4,5-bis(oxidanyl)oxan-3-yl]-2-azanyl-5-[bis(azanyl)methylideneamino]pentanamide

Systemtic Name: (2S)-N-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-2-[2-[(2-azanyl-2-oxidanylidene-ethyl)amino]ethoxy]-4,5-bis(oxidanyl)oxan-3-yl]-2-azanyl-5-[bis(azanyl)methylideneamino]pentanamide Openeye Name: (2S)-2-amino-N-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-2-[2-[(2-amino-2-oxo-ethyl)amino]ethoxy]-4,5-dihydroxy-tetrahydropyran-3-yl]-5-guanidino-pentanamide CAS Name: (2S)-2-amino-N-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-2-[2-[(2-amino-2-oxoethyl)amino]ethoxy]-4,5-dihydroxy-3-oxanyl]-5-(diaminomethylideneamino)pentanamide IUPAC Name: (2S)-2-amino-N-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-2-[2-[(2-amino-2-oxoethyl)amino]ethoxy]-4,5-dihydroxyoxan-3-yl]-5-(diaminomethylideneamino)pentanamide Traditional Name: (2S)-2-amino-N-[(2S,3R,4R,5S,6R)-2-[2-[(2-amino-2-keto-ethyl)amino]ethoxy]-6-(aminomethyl)-4,5-dihydroxy-tetrahydropyran-3-yl]-5-guanidino-valeramide Formula: C16H34N8O6 MolecularWeight: 434.49116

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(C(=O)NC1C(C(C(OC1OCCNCC(=O)N)CN)O)O)N)CN=C(N)N

Isomeric SMILES

C(C[C@@H](C(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1OCCNCC(=O)N)CN)O)O)N)CN=C(N)N

InChI

InChI=1S/C16H34N8O6/c17-6-9-12(26)13(27)11(15(30-9)29-5-4-22-7-10(19)25)24-14(28)8(18)2-1-3-23-16(20)21/h8-9,11-13,15,22,26-27H,1-7,17-18H2,(H2,19,25)(H,24,28)(H4,20,21,23)/t8-,9+,11+,12+,13+,15-/m0/s1