5-azanyl-2-[2-[[2-[[2-[[2-[[2-[2-[[2-[[2-[[4-azanyl-2-[(2-azanyl-4-methyl-pentanoyl)amino]-4-oxidanylidene-butanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]propanoylamino]-4-methyl-pentanoyl]amino]-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[2-[[2-[[2-[[2-[[2-[2-[[2-[[2-[[4-azanyl-2-[(2-azanyl-4-methyl-pentanoyl)amino]-4-oxidanylidene-butanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-5-[bis(azanyl)methylideneamino]pentanoyl]amino]propanoylamino]-4-methyl-pentanoyl]amino]-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[2-[[2-[[2-[[2-[[2-[2-[[2-[[2-[[4-amino-2-[(2-amino-4-methyl-pentanoyl)amino]-4-oxo-butanoyl]amino]-5-guanidino-pentanoyl]amino]-5-guanidino-pentanoyl]amino]propanoylamino]-4-methyl-pentanoyl]amino]-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[4-amino-2-[(2-amino-4-methyl-1-oxopentyl)amino]-1,4-dioxobutyl]amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]-5-(diaminomethylideneamino)-1-oxopentyl]amino]-1-oxopropyl]amino]-4-methyl-1-oxopentyl]amino]-3-methyl-1-oxopentyl]amino]-4-methyl-1-oxopentyl]amino]-4-methyl-1-oxopentyl]amino]-1-oxopropyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[2-[[2-[[2-[[2-[[2-[2-[[2-[[2-[[4-amino-2-[(2-amino-4-methylpentanoyl)amino]-4-oxobutanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]propanoylamino]-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]propanoylamino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[2-[[2-[[2-[[2-[[2-[2-[[2-[[2-[[4-amino-2-[(2-amino-4-methyl-pentanoyl)amino]-4-keto-butanoyl]amino]-5-guanidino-pentanoyl]amino]-5-guanidino-pentanoyl]amino]propanoylamino]-4-methyl-pentanoyl]amino]-3-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoyl]amino]propanoylamino]-5-keto-valeric acid Formula: C57H105N19O14 MolecularWeight: 1280.5625

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C57H105N19O14/c1-13-31(10)44(54(88)75-39(24-29(6)7)51(85)74-38(23-28(4)5)50(84)68-32(11)45(79)71-37(55(89)90)18-19-42(59)77)76-53(87)40(25-30(8)9)72-46(80)33(12)67-48(82)35(16-14-20-65-56(61)62)69-49(83)36(17-15-21-66-57(63)64)70-52(86)41(26-43(60)78)73-47(81)34(58)22-27(2)3/h27-41,44H,13-26,58H2,1-12H3,(H2,59,77)(H2,60,78)(H,67,82)(H,68,84)(H,69,83)(H,70,86)(H,71,79)(H,72,80)(H,73,81)(H,74,85)(H,75,88)(H,76,87)(H,89,90)(H4,61,62,65)(H4,63,64,66)