(4S)-4-(2-azanylethanoylamino)-5-[[(2S)-1-[[(2S)-1-[[(2S)-4-azanyl-1-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-(2-azanylethanoylamino)-5-[[(2S)-1-[[(2S)-1-[[(2S)-4-azanyl-1-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-[(2-aminoacetyl)amino]-5-[[(1S)-1-[[(1S)-1-[[(1S)-3-amino-1-carboxy-3-oxo-propyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-hydroxy-3-oxo-propyl]amino]-5-oxo-pentanoic acid CAS Name: (4S)-5-[[(2S)-1-[[(2S)-1-[[(2S)-4-amino-1-hydroxy-1,4-dioxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-hydroxy-1,4-dioxobutan-2-yl]amino]-4-[(2-amino-1-oxoethyl)amino]-5-oxopentanoic acid IUPAC Name: (4S)-4-[(2-aminoacetyl)amino]-5-[[(2S)-1-[[(2S)-1-[[(2S)-4-amino-1-hydroxy-1,4-dioxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-hydroxy-1,4-dioxobutan-2-yl]amino]-5-oxopentanoic acid Traditional Name: (4S)-5-[[(1S)-1-[[(1S)-1-[[(1S)-3-amino-1-carboxy-3-keto-propyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-hydroxy-3-keto-propyl]amino]-4-(glycylamino)-5-keto-valeric acid Formula: C21H34N6O11 MolecularWeight: 546.52826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC(=O)N)C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)CN

Isomeric SMILES

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

InChI

InChI=1S/C21H34N6O11/c1-9(2)5-11(19(35)27-13(21(37)38)6-14(23)28)25-20(36)12(7-17(32)33)26-18(34)10(3-4-16(30)31)24-15(29)8-22/h9-13H,3-8,22H2,1-2H3,(H2,23,28)(H,24,29)(H,25,36)(H,26,34)(H,27,35)(H,30,31)(H,32,33)(H,37,38)/t10-,11-,12-,13-/m0/s1