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1-[2-[[2-[[2-[2-[[2-[[2-[[2-[[2-[[4-azanyl-2-[[6-azanyl-2-[2-[(2-azanyl-3-methyl-butanoyl)amino]ethanoylamino]hexanoyl]amino]-4-oxidanylidene-butanoyl]amino]-3-methyl-pentanoyl]amino]-3-oxidanyl-butanoyl]amino]-3-methyl-butanoyl]amino]-3-oxidanyl-butanoyl]amino]propanoylamino]-3-oxidanyl-propanoyl]amino]-3-methyl-butanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name:	1-[2-[[2-[[2-[2-[[2-[[2-[[2-[[2-[[4-azanyl-2-[[6-azanyl-2-[2-[(2-azanyl-3-methyl-butanoyl)amino]ethanoylamino]hexanoyl]amino]-4-oxidanylidene-butanoyl]amino]-3-methyl-pentanoyl]amino]-3-oxidanyl-butanoyl]amino]-3-methyl-butanoyl]amino]-3-oxidanyl-butanoyl]amino]propanoylamino]-3-oxidanyl-propanoyl]amino]-3-methyl-butanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylic acid
Openeye Name:	1-[2-[[2-[[2-[2-[[2-[[2-[[2-[[2-[[4-amino-2-[[6-amino-2-[[2-[(2-amino-3-methyl-butanoyl)amino]acetyl]amino]hexanoyl]amino]-4-oxo-butanoyl]amino]-3-methyl-pentanoyl]amino]-3-hydroxy-butanoyl]amino]-3-methyl-butanoyl]amino]-3-hydroxy-butanoyl]amino]propanoylamino]-3-hydroxy-propanoyl]amino]-3-methyl-butanoyl]amino]-4-hydroxy-4-oxo-butanoyl]pyrrolidine-2-carboxylic acid
CAS Name:	1-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[4-amino-2-[[6-amino-2-[[2-[(2-amino-3-methyl-1-oxobutyl)amino]-1-oxoethyl]amino]-1-oxohexyl]amino]-1,4-dioxobutyl]amino]-3-methyl-1-oxopentyl]amino]-3-hydroxy-1-oxobutyl]amino]-3-methyl-1-oxobutyl]amino]-3-hydroxy-1-oxobutyl]amino]-1-oxopropyl]amino]-3-hydroxy-1-oxopropyl]amino]-3-methyl-1-oxobutyl]amino]-4-hydroxy-1,4-dioxobutyl]-2-pyrrolidinecarboxylic acid
IUPAC Name:	1-[2-[[2-[[2-[2-[[2-[[2-[[2-[[2-[[4-amino-2-[[6-amino-2-[[2-[(2-amino-3-methylbutanoyl)amino]acetyl]amino]hexanoyl]amino]-4-oxobutanoyl]amino]-3-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]-3-methylbutanoyl]amino]-3-hydroxybutanoyl]amino]propanoylamino]-3-hydroxypropanoyl]amino]-3-methylbutanoyl]amino]-4-hydroxy-4-oxobutanoyl]pyrrolidine-2-carboxylic acid
Traditional Name:	1-[2-[[2-[[2-[2-[[2-[[2-[[2-[[2-[[4-amino-2-[[6-amino-2-[[2-[(2-amino-3-methyl-butanoyl)amino]acetyl]amino]hexanoyl]amino]-4-keto-butanoyl]amino]-3-methyl-pentanoyl]amino]-3-hydroxy-butanoyl]amino]-3-methyl-butanoyl]amino]-3-hydroxy-butanoyl]amino]propanoylamino]-3-hydroxy-propanoyl]amino]-3-methyl-butanoyl]amino]-4-hydroxy-4-keto-butanoyl]proline
Formula:	C₅₆H₉₇N₁₅O₂₀
MolecularWeight:	1300.45788

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C(C)O)C(=O)NC(C(C)C)C(=O)NC(C(C)O)C(=O)NC(C)C(=O)NC(CO)C(=O)NC(C(C)C)C(=O)NC(CC(=O)O)C(=O)N1CCCC1C(=O)O)NC(=O)C(CC(=O)N)NC(=O)C(CCCCN)NC(=O)CNC(=O)C(C(C)C)N

Isomeric SMILES

CCC(C)C(C(=O)NC(C(C)O)C(=O)NC(C(C)C)C(=O)NC(C(C)O)C(=O)NC(C)C(=O)NC(CO)C(=O)NC(C(C)C)C(=O)NC(CC(=O)O)C(=O)N1CCCC1C(=O)O)NC(=O)C(CC(=O)N)NC(=O)C(CCCCN)NC(=O)CNC(=O)C(C(C)C)N

InChI

InChI=1S/C56H97N15O20/c1-12-27(8)42(68-47(81)32(20-36(58)75)63-46(80)31(16-13-14-18-57)62-37(76)22-60-49(83)39(59)24(2)3)52(86)70-44(30(11)74)54(88)67-41(26(6)7)51(85)69-43(29(10)73)53(87)61-28(9)45(79)65-34(23-72)48(82)66-40(25(4)5)50(84)64-33(21-38(77)78)55(89)71-19-15-17-35(71)56(90)91/h24-35,39-44,72-74H,12-23,57,59H2,1-11H3,(H2,58,75)(H,60,83)(H,61,87)(H,62,76)(H,63,80)(H,64,84)(H,65,79)(H,66,82)(H,67,88)(H,68,81)(H,69,85)(H,70,86)(H,77,78)(H,90,91)

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