(2S)-2-[[(2S)-6-azanyl-2-(2-azanylethanoylamino)hexanoyl]amino]butanedioic acid

Systemtic Name: (2S)-2-[[(2S)-6-azanyl-2-(2-azanylethanoylamino)hexanoyl]amino]butanedioic acid Openeye Name: (2S)-2-[[(2S)-6-amino-2-[(2-aminoacetyl)amino]hexanoyl]amino]butanedioic acid CAS Name: (2S)-2-[[(2S)-6-amino-2-[(2-amino-1-oxoethyl)amino]-1-oxohexyl]amino]butanedioic acid IUPAC Name: (2S)-2-[[(2S)-6-amino-2-[(2-aminoacetyl)amino]hexanoyl]amino]butanedioic acid Traditional Name: (2S)-2-[[(2S)-6-amino-2-(glycylamino)hexanoyl]amino]succinic acid Formula: C12H22N4O6 MolecularWeight: 318.32628

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Descriptors Computed from Structure

Canonical SMILES:

C(CCN)CC(C(=O)NC(CC(=O)O)C(=O)O)NC(=O)CN

Isomeric SMILES

C(CCN)C[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)CN

InChI

InChI=1S/C12H22N4O6/c13-4-2-1-3-7(15-9(17)6-14)11(20)16-8(12(21)22)5-10(18)19/h7-8H,1-6,13-14H2,(H,15,17)(H,16,20)(H,18,19)(H,21,22)/t7-,8-/m0/s1