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6-azanyl-2-[[2-[[2-[[2-[2-[[2-[2-[2-[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl)amino]-3-methyl-butanoyl]amino]-3-oxidanyl-propanoyl]amino]-3-phenyl-propanoyl]amino]-3-oxidanyl-propanoyl]amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]amino]ethanoylamino]ethanoylamino]ethanoylamino]-3-oxidanyl-butanoyl]amino]propanoylamino]-3-oxidanyl-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]hexanoic acid

Systemtic Name:	6-azanyl-2-[[2-[[2-[[2-[2-[[2-[2-[2-[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl)amino]-3-methyl-butanoyl]amino]-3-oxidanyl-propanoyl]amino]-3-phenyl-propanoyl]amino]-3-oxidanyl-propanoyl]amino]-4-methyl-pentanoyl]amino]-3-oxidanyl-propanoyl]amino]ethanoylamino]ethanoylamino]ethanoylamino]-3-oxidanyl-butanoyl]amino]propanoylamino]-3-oxidanyl-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]hexanoic acid
Openeye Name:	6-amino-2-[[2-[[2-[[2-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-4-hydroxy-4-oxo-butanoyl)amino]-3-methyl-butanoyl]amino]-3-hydroxy-propanoyl]amino]-3-phenyl-propanoyl]amino]-3-hydroxy-propanoyl]amino]-4-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]-3-hydroxy-butanoyl]amino]propanoylamino]-3-hydroxy-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-hydroxy-5-oxo-pentanoyl]amino]hexanoic acid
CAS Name:	6-amino-2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-4-hydroxy-1,4-dioxobutyl)amino]-3-methyl-1-oxobutyl]amino]-3-hydroxy-1-oxopropyl]amino]-1-oxo-3-phenylpropyl]amino]-3-hydroxy-1-oxopropyl]amino]-4-methyl-1-oxopentyl]amino]-3-hydroxy-1-oxopropyl]amino]-1-oxoethyl]amino]-1-oxoethyl]amino]-1-oxoethyl]amino]-3-hydroxy-1-oxobutyl]amino]-1-oxopropyl]amino]-3-hydroxy-1-oxopropyl]amino]-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-5-hydroxy-1,5-dioxopentyl]amino]hexanoic acid
IUPAC Name:	6-amino-2-[[2-[[2-[[2-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-4-hydroxy-4-oxobutanoyl)amino]-3-methylbutanoyl]amino]-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-3-hydroxypropanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]-3-hydroxybutanoyl]amino]propanoylamino]-3-hydroxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-hydroxy-5-oxopentanoyl]amino]hexanoic acid
Traditional Name:	6-amino-2-[[2-[[2-[[2-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-amino-4-hydroxy-4-keto-butanoyl)amino]-3-methyl-butanoyl]amino]-3-hydroxy-propanoyl]amino]-3-phenyl-propanoyl]amino]-3-hydroxy-propanoyl]amino]-4-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]-3-hydroxy-butanoyl]amino]propanoylamino]-3-hydroxy-propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-hydroxy-5-keto-pentanoyl]amino]hexanoic acid
Formula:	C₆₉H₁₀₅N₁₇O₂₇
MolecularWeight:	1604.6697

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CO)C(=O)NCC(=O)NCC(=O)NCC(=O)NC(C(C)O)C(=O)NC(C)C(=O)NC(CO)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(CCC(=O)O)C(=O)NC(CCCCN)C(=O)O)NC(=O)C(CO)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CO)NC(=O)C(C(C)C)NC(=O)C(CC(=O)O)N

Isomeric SMILES

InChI

InChI=1S/C69H105N17O27/c1-33(2)22-43(78-65(108)48(31-89)83-63(106)44(23-37-12-8-7-9-13-37)79-66(109)49(32-90)84-67(110)55(34(3)4)86-58(101)40(71)25-54(98)99)61(104)82-46(29-87)59(102)74-27-51(94)72-26-50(93)73-28-52(95)85-56(36(6)91)68(111)75-35(5)57(100)81-47(30-88)64(107)80-45(24-38-15-17-39(92)18-16-38)62(105)76-41(19-20-53(96)97)60(103)77-42(69(112)113)14-10-11-21-70/h7-9,12-13,15-18,33-36,40-49,55-56,87-92H,10-11,14,19-32,70-71H2,1-6H3,(H,72,94)(H,73,93)(H,74,102)(H,75,111)(H,76,105)(H,77,103)(H,78,108)(H,79,109)(H,80,107)(H,81,100)(H,82,104)(H,83,106)(H,84,110)(H,85,95)(H,86,101)(H,96,97)(H,98,99)(H,112,113)