2-[[6-azanyl-2-[[6-azanyl-2-[[6-azanyl-2-[[2-[2,6-bis(azanyl)hexanoylamino]-3-oxidanyl-propanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]propanoic acid

Systemtic Name: 2-[[6-azanyl-2-[[6-azanyl-2-[[6-azanyl-2-[[2-[2,6-bis(azanyl)hexanoylamino]-3-oxidanyl-propanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]propanoic acid Openeye Name: 2-[[6-amino-2-[[6-amino-2-[[6-amino-2-[[2-(2,6-diaminohexanoylamino)-3-hydroxy-propanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]propanoic acid CAS Name: 2-[[6-amino-2-[[6-amino-2-[[6-amino-2-[[2-[(2,6-diamino-1-oxohexyl)amino]-3-hydroxy-1-oxopropyl]amino]-1-oxohexyl]amino]-1-oxohexyl]amino]-1-oxohexyl]amino]propanoic acid IUPAC Name: 2-[[6-amino-2-[[6-amino-2-[[6-amino-2-[[2-(2,6-diaminohexanoylamino)-3-hydroxypropanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]propanoic acid Traditional Name: 2-[[6-amino-2-[[6-amino-2-[[6-amino-2-[[2-(2,6-diaminohexanoylamino)-3-hydroxy-propanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]propionic acid Formula: C30H60N10O8 MolecularWeight: 688.8596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(CO)NC(=O)C(CCCCN)N

Isomeric SMILES

CC(C(=O)O)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(CO)NC(=O)C(CCCCN)N

InChI

InChI=1S/C30H60N10O8/c1-19(30(47)48)36-26(43)21(11-3-7-15-32)37-27(44)22(12-4-8-16-33)38-28(45)23(13-5-9-17-34)39-29(46)24(18-41)40-25(42)20(35)10-2-6-14-31/h19-24,41H,2-18,31-35H2,1H3,(H,36,43)(H,37,44)(H,38,45)(H,39,46)(H,40,42)(H,47,48)