2-[2-[[2-[[2-[[2-[[2-(2-acetamidopropanoylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]amino]ethanoylamino]-5-[bis(azanyl)methylideneamino]pentanoic acid

Systemtic Name: 2-[2-[[2-[[2-[[2-[[2-(2-acetamidopropanoylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]amino]ethanoylamino]-5-[bis(azanyl)methylideneamino]pentanoic acid Openeye Name: 2-[[2-[[2-[[2-[[2-[[2-(2-acetamidopropanoylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]acetyl]amino]-5-guanidino-pentanoic acid CAS Name: 2-[[2-[[2-[[2-[[2-[[2-[(2-acetamido-1-oxopropyl)amino]-3-methyl-1-oxopentyl]amino]-3-methyl-1-oxopentyl]amino]-4-methyl-1-oxopentyl]amino]-3-hydroxy-1-oxopropyl]amino]-1-oxoethyl]amino]-5-(diaminomethylideneamino)pentanoic acid IUPAC Name: 2-[[2-[[2-[[2-[[2-[[2-(2-acetamidopropanoylamino)-3-methylpentanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]-5-(diaminomethylideneamino)pentanoic acid Traditional Name: 2-[[2-[[2-[[2-[[2-[[2-(2-acetamidopropanoylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]acetyl]amino]-5-guanidino-valeric acid Formula: C34H62N10O10 MolecularWeight: 770.91708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C(C)CC)C(=O)NC(CC(C)C)C(=O)NC(CO)C(=O)NCC(=O)NC(CCCN=C(N)N)C(=O)O)NC(=O)C(C)NC(=O)C

Isomeric SMILES

CCC(C)C(C(=O)NC(C(C)CC)C(=O)NC(CC(C)C)C(=O)NC(CO)C(=O)NCC(=O)NC(CCCN=C(N)N)C(=O)O)NC(=O)C(C)NC(=O)C

InChI

InChI=1S/C34H62N10O10/c1-9-18(5)26(44-32(52)27(19(6)10-2)43-28(48)20(7)39-21(8)46)31(51)41-23(14-17(3)4)30(50)42-24(16-45)29(49)38-15-25(47)40-22(33(53)54)12-11-13-37-34(35)36/h17-20,22-24,26-27,45H,9-16H2,1-8H3,(H,38,49)(H,39,46)(H,40,47)(H,41,51)(H,42,50)(H,43,48)(H,44,52)(H,53,54)(H4,35,36,37)