(4S)-4-azanyl-5-[[(2S)-3-(1H-indol-3-yl)-1-[[2-[[(2S)-1-[[(2S)-4-oxidanyl-1,4-bis(oxidanylidene)-1-[[2-oxidanylidene-2-[[(2S)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]ethyl]amino]butan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-azanyl-5-[[(2S)-3-(1H-indol-3-yl)-1-[[2-[[(2S)-1-[[(2S)-4-oxidanyl-1,4-bis(oxidanylidene)-1-[[2-oxidanylidene-2-[[(2S)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]ethyl]amino]butan-2-yl]amino]-1-oxidanylidene-propan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-amino-5-[[(1S)-2-[[2-[[(1S)-2-[[(1S)-3-hydroxy-1-[[2-[[(1S)-2-hydroxy-1-methyl-2-oxo-ethyl]amino]-2-oxo-ethyl]carbamoyl]-3-oxo-propyl]amino]-1-methyl-2-oxo-ethyl]amino]-2-oxo-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: (4S)-4-amino-5-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-4-hydroxy-1-[[2-[[(2S)-1-hydroxy-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,4-dioxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: (4S)-4-amino-5-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-4-hydroxy-1-[[2-[[(2S)-1-hydroxy-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1,4-dioxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: (4S)-4-amino-5-[[(1S)-2-[[2-[[(1S)-2-[[(1S)-3-hydroxy-1-[[2-[[(1S)-2-hydroxy-2-keto-1-methyl-ethyl]amino]-2-keto-ethyl]carbamoyl]-3-keto-propyl]amino]-2-keto-1-methyl-ethyl]amino]-2-keto-ethyl]amino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]amino]-5-keto-valeric acid Formula: C30H40N8O12 MolecularWeight: 704.685

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)O)C(=O)NCC(=O)NC(C)C(=O)O)NC(=O)CNC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C(CCC(=O)O)N

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](C)C(=O)O)NC(=O)CNC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)[C@H](CCC(=O)O)N

InChI

InChI=1S/C30H40N8O12/c1-14(26(45)37-21(10-25(43)44)29(48)34-13-23(40)36-15(2)30(49)50)35-22(39)12-33-28(47)20(38-27(46)18(31)7-8-24(41)42)9-16-11-32-19-6-4-3-5-17(16)19/h3-6,11,14-15,18,20-21,32H,7-10,12-13,31H2,1-2H3,(H,33,47)(H,34,48)(H,35,39)(H,36,40)(H,37,45)(H,38,46)(H,41,42)(H,43,44)(H,49,50)/t14-,15-,18-,20-,21-/m0/s1