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4-[[6-azanyl-2-[[2-[[2-[[6-azanyl-2-[2-[[6-azanyl-2-[[3-methyl-2-[[4-oxidanyl-4-oxidanylidene-2-[[3-oxidanyl-2-[(1-pyrrolidin-2-ylcarbonylpyrrolidin-2-yl)carbonylamino]propanoyl]amino]butanoyl]amino]pentanoyl]amino]hexanoyl]amino]ethanoylamino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methyl-butanoyl]amino]hexanoyl]amino]-5-[[1-[[1-[[1-[[6-azanyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)amino]hexan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-5-oxidanyl-1,5

Systemtic Name:	4-[[6-azanyl-2-[[2-[[2-[[6-azanyl-2-[2-[[6-azanyl-2-[[3-methyl-2-[[4-oxidanyl-4-oxidanylidene-2-[[3-oxidanyl-2-[(1-pyrrolidin-2-ylcarbonylpyrrolidin-2-yl)carbonylamino]propanoyl]amino]butanoyl]amino]pentanoyl]amino]hexanoyl]amino]ethanoylamino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methyl-butanoyl]amino]hexanoyl]amino]-5-[[1-[[1-[[1-[[6-azanyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)amino]hexan-2-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]amino]-5-oxidanyl-1,5
Openeye Name:	4-[[6-amino-2-[[2-[[2-[[6-amino-2-[[2-[[6-amino-2-[[2-[[4-hydroxy-2-[[3-hydroxy-2-[[1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carbonyl]amino]propanoyl]amino]-4-oxo-butanoyl]amino]-3-methyl-pentanoyl]amino]hexanoyl]amino]acetyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methyl-butanoyl]amino]hexanoyl]amino]-5-[[1-[[1-[[1-[[5-amino-1-[[2-hydroxy-2-oxo-1-(sulfanylmethyl)ethyl]carbamoyl]pentyl]carbamoyl]-2-methyl-propyl]carbamoyl]-4-hydroxy-4-oxo-butyl]carbamoyl]-2-methyl-propyl]amino]-5-oxo-pent
CAS Name:	4-[[6-amino-2-[[2-[[2-[[6-amino-2-[[2-[[6-amino-2-[[2-[[4-hydroxy-2-[[3-hydroxy-1-oxo-2-[[oxo-[1-[oxo(2-pyrrolidinyl)methyl]-2-pyrrolidinyl]methyl]amino]propyl]amino]-1,4-dioxobutyl]amino]-3-methyl-1-oxopentyl]amino]-1-oxohexyl]amino]-1-oxoethyl]amino]-1-oxohexyl]amino]-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-methyl-1-oxobutyl]amino]-1-oxohexyl]amino]-5-[[1-[[1-[[1-[[6-amino-1-[(1-hydroxy-3-mercapto-1-oxopropan-2-yl)amino]-1-oxohexan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-hydroxy-1,5-dioxopentan-2-y
IUPAC Name:	4-[[6-amino-2-[[2-[[2-[[6-amino-2-[[2-[[6-amino-2-[[2-[[4-hydroxy-2-[[3-hydroxy-2-[[1-(pyrrolidine-2-carbonyl)pyrrolidine-2-carbonyl]amino]propanoyl]amino]-4-oxobutanoyl]amino]-3-methylpentanoyl]amino]hexanoyl]amino]acetyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]hexanoyl]amino]-5-[[1-[[1-[[1-[[6-amino-1-[(1-hydroxy-1-oxo-3-sulfanylpropan-2-yl)amino]-1-oxohexan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-hydroxy-1,5-dioxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]a
Traditional Name:	4-[[6-amino-2-[[2-[[2-[[6-amino-2-[[2-[[6-amino-2-[[2-[[4-hydroxy-2-[[3-hydroxy-2-[(1-prolylprolyl)amino]propanoyl]amino]-4-keto-butanoyl]amino]-3-methyl-pentanoyl]amino]hexanoyl]amino]acetyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methyl-butanoyl]amino]hexanoyl]amino]-5-[[1-[[1-[[1-[[5-amino-1-[[2-hydroxy-2-keto-1-(mercaptomethyl)ethyl]carbamoyl]pentyl]carbamoyl]-2-methyl-propyl]carbamoyl]-4-hydroxy-4-keto-butyl]carbamoyl]-2-methyl-propyl]amino]-5-keto-valeric acid
Formula:	C₈₆H₁₄₃N₂₁O₂₆S
MolecularWeight:	1919.24572

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CCCCN)C(=O)NCC(=O)NC(CCCCN)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(C(C)C)C(=O)NC(CCCCN)C(=O)NC(CCC(=O)O)C(=O)NC(C(C)C)C(=O)NC(CCC(=O)O)C(=O)NC(C(C)C)C(=O)NC(CCCCN)C(=O)NC(CS)C(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CO)NC(=O)C2CCCN2C(=O)C3CCCN3

Isomeric SMILES

InChI

InChI=1S/C86H143N21O26S/c1-9-48(8)70(106-78(124)59(41-66(115)116)100-79(125)60(43-108)101-80(126)62-25-19-39-107(62)85(131)57-24-18-38-91-57)84(130)95-51(20-10-14-34-87)71(117)92-42-63(110)93-52(21-11-15-35-88)72(118)99-58(40-49-26-28-50(109)29-27-49)77(123)105-69(47(6)7)82(128)96-53(22-12-16-36-89)73(119)94-55(30-32-64(111)112)75(121)103-68(46(4)5)83(129)98-56(31-33-65(113)114)76(122)104-67(45(2)3)81(127)97-54(23-13-17-37-90)74(120)102-61(44-134)86(132)133/h26-29,45-48,51-62,67-70,91,108-109,134H,9-25,30-44,87-90H2,1-8H3,(H,92,117)(H,93,110)(H,94,119)(H,95,130)(H,96,128)(H,97,127)(H,98,129)(H,99,118)(H,100,125)(H,101,126)(H,102,120)(H,103,121)(H,104,122)(H,105,123)(H,106,124)(H,111,112)(H,113,114)(H,115,116)(H,132,133)

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