[2,5-bis(oxidanylidene)pyrrolidin-1-yl] 6-azanyl-2-[[2-[[6-azanyl-2-[[3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrolidin-1-yl] 6-azanyl-2-[[2-[[6-azanyl-2-[[3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoate Openeye Name: (2,5-dioxopyrrolidin-1-yl) 6-amino-2-[[2-[[6-amino-2-[[2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoate CAS Name: 6-amino-2-[[2-[[6-amino-2-[[3-(4-hydroxyphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]-1-oxohexyl]amino]-3-(4-hydroxyphenyl)-1-oxopropyl]amino]hexanoic acid (2,5-dioxo-1-pyrrolidinyl) ester IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 6-amino-2-[[2-[[6-amino-2-[[3-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoate Traditional Name: 6-amino-2-[[2-[[6-amino-2-[[2-(tert-butoxycarbonylamino)-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoic acid succinimido ester Formula: C39H55N7O11 MolecularWeight: 797.8943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(CCCCN)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)NC(CCCCN)C(=O)ON3C(=O)CCC3=O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(CCCCN)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)NC(CCCCN)C(=O)ON3C(=O)CCC3=O

InChI

InChI=1S/C39H55N7O11/c1-39(2,3)56-38(55)45-31(23-25-12-16-27(48)17-13-25)36(53)42-28(8-4-6-20-40)34(51)44-30(22-24-10-14-26(47)15-11-24)35(52)43-29(9-5-7-21-41)37(54)57-46-32(49)18-19-33(46)50/h10-17,28-31,47-48H,4-9,18-23,40-41H2,1-3H3,(H,42,53)(H,43,52)(H,44,51)(H,45,55)