[(4S)-4-[[(2S)-2-(2-azanylethanoylamino)propanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentyl]-[bis(azanyl)methylidene]azanium

Systemtic Name: [(4S)-4-[[(2S)-2-(2-azanylethanoylamino)propanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentyl]-[bis(azanyl)methylidene]azanium Openeye Name: [(4S)-4-[[(2S)-2-[(2-aminoacetyl)amino]propanoyl]amino]-5-hydroxy-5-oxo-pentyl]-(diaminomethylene)ammonium CAS Name: [(4S)-4-[[(2S)-2-[(2-amino-1-oxoethyl)amino]-1-oxopropyl]amino]-5-hydroxy-5-oxopentyl]-(diaminomethylidene)ammonium IUPAC Name: [(4S)-4-[[(2S)-2-[(2-aminoacetyl)amino]propanoyl]amino]-5-hydroxy-5-oxopentyl]-(diaminomethylidene)azanium Traditional Name: diaminomethylene-[(4S)-4-[[(2S)-2-(glycylamino)propanoyl]amino]-5-hydroxy-5-keto-pentyl]ammonium Formula: C11H23N6O4+ MolecularWeight: 303.33812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCC[NH+]=C(N)N)C(=O)O)NC(=O)CN

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CCC[NH+]=C(N)N)C(=O)O)NC(=O)CN

InChI

InChI=1S/C11H22N6O4/c1-6(16-8(18)5-12)9(19)17-7(10(20)21)3-2-4-15-11(13)14/h6-7H,2-5,12H2,1H3,(H,16,18)(H,17,19)(H,20,21)(H4,13,14,15)/p+1/t6-,7-/m0/s1