2-[[1-[2-[[3-oxidanyl-2-[[3-oxidanyl-2-[[3-oxidanyl-2-[2-[(1-pyrrolidin-2-ylcarbonylpyrrolidin-2-yl)carbonylamino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidin-2-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[1-[2-[[3-oxidanyl-2-[[3-oxidanyl-2-[[3-oxidanyl-2-[2-[(1-pyrrolidin-2-ylcarbonylpyrrolidin-2-yl)carbonylamino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidin-2-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[1-[2-[[3-hydroxy-2-[[3-hydroxy-2-[[3-hydroxy-2-[2-[[1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carbonyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]acetic acid CAS Name: 2-[[[1-[2-[[3-hydroxy-2-[[3-hydroxy-2-[[3-hydroxy-1-oxo-2-[[1-oxo-2-[[oxo-[1-[oxo(2-pyrrolidinyl)methyl]-2-pyrrolidinyl]methyl]amino]propyl]amino]propyl]amino]-1-oxopropyl]amino]-1-oxopropyl]amino]-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[1-[2-[[3-hydroxy-2-[[3-hydroxy-2-[[3-hydroxy-2-[2-[[1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carbonyl]amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]pyrrolidine-2-carbonyl]amino]acetic acid Traditional Name: 2-[[1-[2-[[3-hydroxy-2-[[3-hydroxy-2-[[3-hydroxy-2-[2-[(1-prolylprolyl)amino]propanoylamino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]prolyl]amino]acetic acid Formula: C32H51N9O13 MolecularWeight: 769.79984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CO)C(=O)NC(CO)C(=O)NC(CO)C(=O)NC(C)C(=O)N1CCCC1C(=O)NCC(=O)O)NC(=O)C2CCCN2C(=O)C3CCCN3

Isomeric SMILES

CC(C(=O)NC(CO)C(=O)NC(CO)C(=O)NC(CO)C(=O)NC(C)C(=O)N1CCCC1C(=O)NCC(=O)O)NC(=O)C2CCCN2C(=O)C3CCCN3

InChI

InChI=1S/C32H51N9O13/c1-16(35-30(52)23-8-5-11-41(23)32(54)18-6-3-9-33-18)25(47)37-20(14-43)27(49)39-21(15-44)28(50)38-19(13-42)26(48)36-17(2)31(53)40-10-4-7-22(40)29(51)34-12-24(45)46/h16-23,33,42-44H,3-15H2,1-2H3,(H,34,51)(H,35,52)(H,36,48)(H,37,47)(H,38,50)(H,39,49)(H,45,46)