2-[[2-[2-[2-[2-[[2-[[2-[2-[[2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-3-oxidanyl-propanoyl]amino]propanoylamino]-3-methyl-butanoyl]amino]-3-oxidanyl-propanoyl]amino]ethanoylamino]ethanoylamino]propanoylamino]-3-oxidanyl-propanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2-[2-[2-[2-[[2-[[2-[2-[[2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-3-oxidanyl-propanoyl]amino]propanoylamino]-3-methyl-butanoyl]amino]-3-oxidanyl-propanoyl]amino]ethanoylamino]ethanoylamino]propanoylamino]-3-oxidanyl-propanoyl]amino]ethanoic acid Openeye Name: 2-[[2-[2-[[2-[[2-[[2-[[2-[2-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxy-propanoyl]amino]propanoylamino]-3-methyl-butanoyl]amino]-3-hydroxy-propanoyl]amino]acetyl]amino]acetyl]amino]propanoylamino]-3-hydroxy-propanoyl]amino]acetic acid CAS Name: 2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-hydroxy-1-oxopropyl]amino]-1-oxopropyl]amino]-3-methyl-1-oxobutyl]amino]-3-hydroxy-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxoethyl]amino]-1-oxopropyl]amino]-3-hydroxy-1-oxopropyl]amino]acetic acid IUPAC Name: 2-[[2-[2-[[2-[[2-[[2-[[2-[2-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]propanoylamino]-3-methylbutanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]acetyl]amino]propanoylamino]-3-hydroxypropanoyl]amino]acetic acid Traditional Name: 2-[[3-hydroxy-2-[2-[[2-[[2-[[3-hydroxy-2-[[2-[2-[[3-hydroxy-2-(tyrosylamino)propanoyl]amino]propanoylamino]-3-methyl-butanoyl]amino]propanoyl]amino]acetyl]amino]acetyl]amino]propanoylamino]propanoyl]amino]acetic acid Formula: C35H54N10O15 MolecularWeight: 854.86126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CO)C(=O)NCC(=O)NCC(=O)NC(C)C(=O)NC(CO)C(=O)NCC(=O)O)NC(=O)C(C)NC(=O)C(CO)NC(=O)C(CC1=CC=C(C=C1)O)N

Isomeric SMILES

CC(C)C(C(=O)NC(CO)C(=O)NCC(=O)NCC(=O)NC(C)C(=O)NC(CO)C(=O)NCC(=O)O)NC(=O)C(C)NC(=O)C(CO)NC(=O)C(CC1=CC=C(C=C1)O)N

InChI

InChI=1S/C35H54N10O15/c1-16(2)28(45-30(55)18(4)41-34(59)24(15-48)43-31(56)21(36)9-19-5-7-20(49)8-6-19)35(60)44-23(14-47)32(57)38-10-25(50)37-11-26(51)40-17(3)29(54)42-22(13-46)33(58)39-12-27(52)53/h5-8,16-18,21-24,28,46-49H,9-15,36H2,1-4H3,(H,37,50)(H,38,57)(H,39,58)(H,40,51)(H,41,59)(H,42,54)(H,43,56)(H,44,60)(H,45,55)(H,52,53)