2-[2-[[2-[[2-[[2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]butanedioic acid

Systemtic Name: 2-[2-[[2-[[2-[[2-[[2-azanyl-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]butanedioic acid Openeye Name: 2-[2-[[2-[[2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]butanedioic acid CAS Name: 2-[[2-[[2-[[2-[[2-[[2-amino-3-(1H-indol-3-yl)-1-oxopropyl]amino]-4-methyl-1-oxopentyl]amino]-3-(1H-indol-3-yl)-1-oxopropyl]amino]-4-methyl-1-oxopentyl]amino]-1-oxopropyl]amino]butanedioic acid IUPAC Name: 2-[2-[[2-[[2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-methylpentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylpentanoyl]amino]propanoylamino]butanedioic acid Traditional Name: 2-[2-[[2-[[2-[[2-[[2-amino-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]succinic acid Formula: C41H54N8O9 MolecularWeight: 802.91566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(CC(=O)O)C(=O)O)NC(=O)C(CC3=CNC4=CC=CC=C43)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(CC(=O)O)C(=O)O)NC(=O)C(CC3=CNC4=CC=CC=C43)N

InChI

InChI=1S/C41H54N8O9/c1-21(2)14-31(38(54)45-23(5)36(52)49-34(41(57)58)18-35(50)51)47-40(56)33(17-25-20-44-30-13-9-7-11-27(25)30)48-39(55)32(15-22(3)4)46-37(53)28(42)16-24-19-43-29-12-8-6-10-26(24)29/h6-13,19-23,28,31-34,43-44H,14-18,42H2,1-5H3,(H,45,54)(H,46,53)(H,47,56)(H,48,55)(H,49,52)(H,50,51)(H,57,58)