1-[2-[[2-[[5-[bis(azanyl)methylideneamino]-2-[[1-[5-[bis(azanyl)methylideneamino]-2-[[1-[2-[[3-methyl-2-(pyrrolidin-2-ylcarbonylamino)butanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]pyrrolidin-2-yl]carbonylamino]pentanoyl]pyrrolidin-2-yl]carbonylamino]pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[2-[[5-[bis(azanyl)methylideneamino]-2-[[1-[5-[bis(azanyl)methylideneamino]-2-[[1-[2-[[3-methyl-2-(pyrrolidin-2-ylcarbonylamino)butanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]pyrrolidin-2-yl]carbonylamino]pentanoyl]pyrrolidin-2-yl]carbonylamino]pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[2-[[5-guanidino-2-[[1-[5-guanidino-2-[[1-[4-hydroxy-2-[[3-methyl-2-(pyrrolidine-2-carbonylamino)butanoyl]amino]-4-oxo-butanoyl]pyrrolidine-2-carbonyl]amino]pentanoyl]pyrrolidine-2-carbonyl]amino]pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-hydroxy-5-oxo-pentanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[2-[[5-(diaminomethylideneamino)-2-[[[1-[5-(diaminomethylideneamino)-2-[[[1-[4-hydroxy-2-[[3-methyl-1-oxo-2-[[oxo(2-pyrrolidinyl)methyl]amino]butyl]amino]-1,4-dioxobutyl]-2-pyrrolidinyl]-oxomethyl]amino]-1-oxopentyl]-2-pyrrolidinyl]-oxomethyl]amino]-1-oxopentyl]amino]-4-methyl-1-oxopentyl]amino]-5-hydroxy-1,5-dioxopentyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[2-[[5-(diaminomethylideneamino)-2-[[1-[5-(diaminomethylideneamino)-2-[[1-[4-hydroxy-2-[[3-methyl-2-(pyrrolidine-2-carbonylamino)butanoyl]amino]-4-oxobutanoyl]pyrrolidine-2-carbonyl]amino]pentanoyl]pyrrolidine-2-carbonyl]amino]pentanoyl]amino]-4-methylpentanoyl]amino]-5-hydroxy-5-oxopentanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[2-[[5-guanidino-2-[[1-[5-guanidino-2-[[1-[4-hydroxy-4-keto-2-[[3-methyl-2-(prolylamino)butanoyl]amino]butanoyl]prolyl]amino]pentanoyl]prolyl]amino]pentanoyl]amino]-4-methyl-pentanoyl]amino]-5-hydroxy-5-keto-pentanoyl]proline Formula: C52H86N16O15 MolecularWeight: 1175.33744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CCC(=O)O)C(=O)N1CCCC1C(=O)O)NC(=O)C(CCCN=C(N)N)NC(=O)C2CCCN2C(=O)C(CCCN=C(N)N)NC(=O)C3CCCN3C(=O)C(CC(=O)O)NC(=O)C(C(C)C)NC(=O)C4CCCN4

Isomeric SMILES

CC(C)CC(C(=O)NC(CCC(=O)O)C(=O)N1CCCC1C(=O)O)NC(=O)C(CCCN=C(N)N)NC(=O)C2CCCN2C(=O)C(CCCN=C(N)N)NC(=O)C3CCCN3C(=O)C(CC(=O)O)NC(=O)C(C(C)C)NC(=O)C4CCCN4

InChI

InChI=1S/C52H86N16O15/c1-27(2)25-33(43(75)61-32(17-18-38(69)70)48(80)68-24-10-16-37(68)50(82)83)63-42(74)30(12-6-20-58-51(53)54)60-44(76)35-14-8-22-66(35)47(79)31(13-7-21-59-52(55)56)62-45(77)36-15-9-23-67(36)49(81)34(26-39(71)72)64-46(78)40(28(3)4)65-41(73)29-11-5-19-57-29/h27-37,40,57H,5-26H2,1-4H3,(H,60,76)(H,61,75)(H,62,77)(H,63,74)(H,64,78)(H,65,73)(H,69,70)(H,71,72)(H,82,83)(H4,53,54,58)(H4,55,56,59)