6-azanyl-2-[[2-[[6-azanyl-2-[[6-azanyl-2-[[6-azanyl-2-(pyrrolidin-2-ylcarbonylamino)hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[2-[[6-azanyl-2-[[6-azanyl-2-[[6-azanyl-2-(pyrrolidin-2-ylcarbonylamino)hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]hexanoic acid Openeye Name: 6-amino-2-[[2-[[6-amino-2-[[6-amino-2-[[6-amino-2-(pyrrolidine-2-carbonylamino)hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-5-guanidino-pentanoyl]amino]hexanoic acid CAS Name: 6-amino-2-[[2-[[6-amino-2-[[6-amino-2-[[6-amino-1-oxo-2-[[oxo(2-pyrrolidinyl)methyl]amino]hexyl]amino]-1-oxohexyl]amino]-1-oxohexyl]amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[[2-[[6-amino-2-[[6-amino-2-[[6-amino-2-(pyrrolidine-2-carbonylamino)hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]hexanoic acid Traditional Name: 6-amino-2-[[2-[[6-amino-2-[[6-amino-2-[[6-amino-2-(prolylamino)hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-5-guanidino-pentanoyl]amino]hexanoic acid Formula: C35H69N13O7 MolecularWeight: 784.00526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(CCCN=C(N)N)C(=O)NC(CCCCN)C(=O)O

Isomeric SMILES

C1CC(NC1)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)NC(CCCN=C(N)N)C(=O)NC(CCCCN)C(=O)O

InChI

InChI=1S/C35H69N13O7/c36-17-5-1-11-24(44-29(49)23-15-9-21-42-23)30(50)45-25(12-2-6-18-37)31(51)46-26(13-3-7-19-38)32(52)47-27(16-10-22-43-35(40)41)33(53)48-28(34(54)55)14-4-8-20-39/h23-28,42H,1-22,36-39H2,(H,44,49)(H,45,50)(H,46,51)(H,47,52)(H,48,53)(H,54,55)(H4,40,41,43)