(3S)-4-[[(2R)-1-[(2S)-2-aminocarbonylpyrrolidin-1-yl]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-[2-[[(2S)-2-(2-azanylethanoylamino)-5-[bis(azanyl)methylideneamino]pentanoyl]amino]ethanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-4-[[(2R)-1-[(2S)-2-aminocarbonylpyrrolidin-1-yl]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-3-[2-[[(2S)-2-(2-azanylethanoylamino)-5-[bis(azanyl)methylideneamino]pentanoyl]amino]ethanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-[[2-[[(2S)-2-[(2-aminoacetyl)amino]-5-guanidino-pentanoyl]amino]acetyl]amino]-4-[[(1R)-2-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-(hydroxymethyl)-2-oxo-ethyl]amino]-4-oxo-butanoic acid CAS Name: (3S)-3-[[2-[[(2S)-2-[(2-amino-1-oxoethyl)amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]-1-oxoethyl]amino]-4-[[(2R)-1-[(2S)-2-carbamoyl-1-pyrrolidinyl]-3-hydroxy-1-oxopropan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: (3S)-3-[[2-[[(2S)-2-[(2-aminoacetyl)amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]-4-[[(2R)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-3-hydroxy-1-oxopropan-2-yl]amino]-4-oxobutanoic acid Traditional Name: (3S)-4-[[(1R)-2-[(2S)-2-carbamoylpyrrolidino]-2-keto-1-methylol-ethyl]amino]-3-[[2-[[(2S)-2-(glycylamino)-5-guanidino-pentanoyl]amino]acetyl]amino]-4-keto-butyric acid Formula: C22H38N10O9 MolecularWeight: 586.59872

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CO)NC(=O)C(CC(=O)O)NC(=O)CNC(=O)C(CCCN=C(N)N)NC(=O)CN)C(=O)N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)[C@@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)CN)C(=O)N

InChI

InChI=1S/C22H38N10O9/c23-8-15(34)29-11(3-1-5-27-22(25)26)19(39)28-9-16(35)30-12(7-17(36)37)20(40)31-13(10-33)21(41)32-6-2-4-14(32)18(24)38/h11-14,33H,1-10,23H2,(H2,24,38)(H,28,39)(H,29,34)(H,30,35)(H,31,40)(H,36,37)(H4,25,26,27)/t11-,12-,13+,14-/m0/s1