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N-[1-[[1-[[2-[[6-azanyl-1-[[1-[[1-[[2-[[1-[[1-[(1-azanyl-3-oxidanyl-1-oxidanylidene-butan-2-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-1-[2-[(2-azanyl-3-methyl-pentanoyl)amino]-3-methyl-butanoyl]

N-[1-[[1-[[2-[[6-azanyl-1-[[1-[[1-[[2-[[1-[[1-[(1-azanyl-3-oxidanyl-1-oxidanylidene-butan-2-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-1-[2-[(2-azanyl-3-methyl-pentanoyl)amino]-3-methyl-butanoyl]

Systemtic Name:N-[1-[[1-[[2-[[6-azanyl-1-[[1-[[1-[[2-[[1-[[1-[(1-azanyl-3-oxidanyl-1-oxidanylidene-butan-2-yl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]-1-[2-[(2-azanyl-3-methyl-pentanoyl)amino]-3-methyl-butanoyl]
Openeye Name:N-[2-[[1-[[2-[[5-amino-1-[[1-[[1-[[2-[[1-[[1-[(1-carbamoyl-2-hydroxy-propyl)carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]amino]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]carbamoyl]pentyl]amino]-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]amino]-1-benzyl-2-oxo-ethyl]-1-[2-[(2-amino-3-methyl-pentanoyl)amino]-3-methyl-butanoyl]pyrrolidine-2-carboxamide
CAS Name:N-[1-[[1-[[2-[[6-amino-1-[[1-[[1-[[2-[[1-[[1-[(1-amino-3-hydroxy-1-oxobutan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-1-[2-[(2-amino-3-methyl-1-oxopentyl)amino]-3-methyl-1-oxobutyl]-2-pyrrolidinecarboxamide
IUPAC Name:N-[1-[[1-[[2-[[6-amino-1-[[1-[[1-[[2-[[1-[[1-[(1-amino-3-hydroxy-1-oxobutan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-1-[2-[(2-amino-3-methylpentanoyl)amino]-3-methylbutanoyl]pyrrolidine-2-carboxamide
Traditional Name:N-[2-[[1-[[2-[[5-amino-1-[[1-[[1-[[2-[[1-[[1-[(1-carbamoyl-2-hydroxy-propyl)carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]amino]-2-keto-ethyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]carbamoyl]pentyl]amino]-2-keto-ethyl]carbamoyl]-3-methyl-butyl]amino]-1-benzyl-2-keto-ethyl]-1-[2-[(2-amino-3-methyl-pentanoyl)amino]-3-methyl-butanoyl]pyrrolidine-2-carboxamide
Formula: C69H119N15O14
MolecularWeight: 1382.77526
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC(C)C)C(=O)NCC(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(C(C)O)C(=O)N)N


Isomeric SMILES

CCC(C)C(C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC(C)C)C(=O)NCC(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(C(C)O)C(=O)N)N


InChI

InChI=1S/C69H119N15O14/c1-16-43(14)56(71)68(97)82-57(42(12)13)69(98)84-28-22-26-53(84)67(96)81-52(34-45-23-18-17-19-24-45)65(94)78-48(30-38(4)5)61(90)73-35-54(86)75-46(25-20-21-27-70)62(91)79-50(32-40(8)9)64(93)77-47(29-37(2)3)60(89)74-36-55(87)76-49(31-39(6)7)63(92)80-51(33-41(10)11)66(95)83-58(44(15)85)59(72)88/h17-19,23-24,37-44,46-53,56-58,85H,16,20-22,25-36,70-71H2,1-15H3,(H2,72,88)(H,73,90)(H,74,89)(H,75,86)(H,76,87)(H,77,93)(H,78,94)(H,79,91)(H,80,92)(H,81,96)(H,82,97)(H,83,95)


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