(4S)-4-azanyl-5-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(3S)-7-azanyl-2-oxidanylidene-heptan-3-yl]amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-4-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-azanyl-5-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(3S)-7-azanyl-2-oxidanylidene-heptan-3-yl]amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-4-oxidanyl-1,4-bis(oxidanylidene)butan-2-yl]amino]-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-5-[[(1S)-1-[[(1S)-1-[[(1R)-2-[[(1S)-1-acetyl-5-amino-pentyl]amino]-2-oxo-1-(sulfanylmethyl)ethyl]carbamoyl]-3-hydroxy-3-oxo-propyl]carbamoyl]-4-hydroxy-4-oxo-butyl]amino]-4-amino-5-oxo-pentanoic acid CAS Name: (4S)-4-amino-5-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(3S)-7-amino-2-oxoheptan-3-yl]amino]-3-mercapto-1-oxopropan-2-yl]amino]-4-hydroxy-1,4-dioxobutan-2-yl]amino]-5-hydroxy-1,5-dioxopentan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: (4S)-4-amino-5-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(3S)-7-amino-2-oxoheptan-3-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-4-hydroxy-1,4-dioxobutan-2-yl]amino]-5-hydroxy-1,5-dioxopentan-2-yl]amino]-5-oxopentanoic acid Traditional Name: (4S)-5-[[(1S)-1-[[(1S)-1-[[(1R)-2-[[(1S)-1-acetyl-5-amino-pentyl]amino]-2-keto-1-(mercaptomethyl)ethyl]carbamoyl]-3-hydroxy-3-keto-propyl]carbamoyl]-4-hydroxy-4-keto-butyl]amino]-4-amino-5-keto-valeric acid Formula: C24H40N6O11S MolecularWeight: 620.673

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCCCN)NC(=O)C(CS)NC(=O)C(CC(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)O)N

Isomeric SMILES

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

InChI

InChI=1S/C24H40N6O11S/c1-12(31)14(4-2-3-9-25)27-24(41)17(11-42)30-23(40)16(10-20(36)37)29-22(39)15(6-8-19(34)35)28-21(38)13(26)5-7-18(32)33/h13-17,42H,2-11,25-26H2,1H3,(H,27,41)(H,28,38)(H,29,39)(H,30,40)(H,32,33)(H,34,35)(H,36,37)/t13-,14-,15-,16-,17-/m0/s1