2-[[1-[2-[[3-oxidanyl-2-[[3-oxidanyl-2-[[3-oxidanyl-2-[2-[(1-pyrrolidin-2-ylcarbonylpyrrolidin-2-yl)carbonylamino]propanoylamino]propanoyl]amino]butanoyl]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]butanoyl]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]butanoyl]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-oxobutyl]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]butanoyl]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]butanoyl]amino]propanoyl]amino]propanoyl]prolyl]amino]acetic acid Formula: C33H53N9O13 MolecularWeight: 783.82642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H53N9O13/c1-16(36-30(52)23-9-6-12-42(23)33(55)19-7-4-10-34-19)26(48)38-21(15-44)28(50)40-25(18(3)45)31(53)39-20(14-43)27(49)37-17(2)32(54)41-11-5-8-22(41)29(51)35-13-24(46)47/h16-23,25,34,43-45H,4-15H2,1-3H3,(H,35,51)(H,36,52)(H,37,49)(H,38,48)(H,39,53)(H,40,50)(H,46,47)