(2S)-2-[2-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-3-(2-azanylethanoylamino)-4,5-bis(oxidanyl)oxan-2-yl]oxyethylamino]propanamide

Systemtic Name: (2S)-2-[2-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-3-(2-azanylethanoylamino)-4,5-bis(oxidanyl)oxan-2-yl]oxyethylamino]propanamide Openeye Name: (2S)-2-[2-[(2S,3R,4R,5S,6R)-3-[(2-aminoacetyl)amino]-6-(aminomethyl)-4,5-dihydroxy-tetrahydropyran-2-yl]oxyethylamino]propanamide CAS Name: (2S)-2-[2-[[(2S,3R,4R,5S,6R)-6-(aminomethyl)-3-[(2-amino-1-oxoethyl)amino]-4,5-dihydroxy-2-oxanyl]oxy]ethylamino]propanamide IUPAC Name: (2S)-2-[2-[(2S,3R,4R,5S,6R)-3-[(2-aminoacetyl)amino]-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxyethylamino]propanamide Traditional Name: (2S)-2-[2-[(2S,3R,4R,5S,6R)-6-(aminomethyl)-3-(glycylamino)-4,5-dihydroxy-tetrahydropyran-2-yl]oxyethylamino]propionamide Formula: C13H27N5O6 MolecularWeight: 349.38338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H27N5O6/c1-6(12(16)22)17-2-3-23-13-9(18-8(19)5-15)11(21)10(20)7(4-14)24-13/h6-7,9-11,13,17,20-21H,2-5,14-15H2,1H3,(H2,16,22)(H,18,19)/t6-,7+,9+,10+,11+,13-/m0/s1