[(2R,3R,4S,5R)-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]methyl (2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoate

Systemtic Name: [(2R,3R,4S,5R)-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]methyl (2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoate Openeye Name: [(2R,3R,4S,5R)-3,4,5,6-tetrahydroxytetrahydropyran-2-yl]methyl (2S)-2-amino-5-guanidino-pentanoate CAS Name: (2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid [(2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-2-oxanyl]methyl ester IUPAC Name: [(2R,3R,4S,5R)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl (2S)-2-amino-5-(diaminomethylideneamino)pentanoate Traditional Name: (2S)-2-amino-5-guanidino-valeric acid [(2R,3R,4S,5R)-3,4,5,6-tetrahydroxytetrahydropyran-2-yl]methyl ester Formula: C12H24N4O7 MolecularWeight: 336.34156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CC(C(=O)OCC1C(C(C(C(O1)O)O)O)O)N)CN=C(N)N

Isomeric SMILES

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

InChI

InChI=1S/C12H24N4O7/c13-5(2-1-3-16-12(14)15)10(20)22-4-6-7(17)8(18)9(19)11(21)23-6/h5-9,11,17-19,21H,1-4,13H2,(H4,14,15,16)/t5-,6+,7-,8-,9+,11?/m0/s1