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phenacyl (2S)-1-[(2S)-2-[[(2S)-3-cyclohexyl-2-[[(2S)-3-methyl-2-[methyl-[(2R)-3-methyl-2-[(2S)-3-methyl-2-[methyl-[(2S)-4-methyl-2-[[(2S)-3-methyl-2-[methyl-[(2S,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]butanoyl]amino]pentanoyl]amino]-3-oxidanyl-butanoyl]oxy-pentanoyl]amino]butanoyl]amino]propanoyl]-methyl-amino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylate

Systemtic Name:	phenacyl (2S)-1-[(2S)-2-[[(2S)-3-cyclohexyl-2-[[(2S)-3-methyl-2-[methyl-[(2R)-3-methyl-2-[(2S)-3-methyl-2-[methyl-[(2S)-4-methyl-2-[[(2S)-3-methyl-2-[methyl-[(2S,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]butanoyl]amino]pentanoyl]amino]-3-oxidanyl-butanoyl]oxy-pentanoyl]amino]butanoyl]amino]propanoyl]-methyl-amino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylate
Openeye Name:	phenacyl (2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-(tert-butoxycarbonylamino)-3-methyl-pentanoyl]-methyl-amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]-methyl-amino]-3-hydroxy-3-methyl-butanoyl]oxy-3-methyl-pentanoyl]-methyl-amino]-3-methyl-butanoyl]amino]-3-cyclohexyl-propanoyl]-methyl-amino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylate
CAS Name:	(2S)-1-[(2S)-2-[[(2S)-3-cyclohexyl-2-[[(2S)-2-[[(2R)-2-[(2S)-3-hydroxy-3-methyl-2-[methyl-[(2S)-4-methyl-2-[[(2S)-3-methyl-2-[methyl-[(2S,3R)-3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopentyl]amino]-1-oxobutyl]amino]-1-oxopentyl]amino]-1-oxobutoxy]-3-methyl-1-oxopentyl]-methylamino]-3-methyl-1-oxobutyl]amino]-1-oxopropyl]-methylamino]-1-oxo-3-phenylpropyl]-2-pyrrolidinecarboxylic acid phenacyl ester
IUPAC Name:	phenacyl (2S)-1-[(2S)-2-[[(2S)-3-cyclohexyl-2-[[(2S)-2-[[(2R)-2-[(2S)-3-hydroxy-3-methyl-2-[methyl-[(2S)-4-methyl-2-[[(2S)-3-methyl-2-[methyl-[(2S,3R)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]butanoyl]amino]pentanoyl]amino]butanoyl]oxy-3-methylpentanoyl]-methylamino]-3-methylbutanoyl]amino]propanoyl]-methylamino]-3-phenylpropanoyl]pyrrolidine-2-carboxylate
Traditional Name:	(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-(tert-butoxycarbonylamino)-3-methyl-pentanoyl]-methyl-amino]-3-methyl-butanoyl]amino]-4-methyl-pentanoyl]-methyl-amino]-3-hydroxy-3-methyl-butanoyl]oxy-3-methyl-pentanoyl]-methyl-amino]-3-methyl-butanoyl]amino]-3-cyclohexyl-propanoyl]-methyl-amino]-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid phenacyl ester
Formula:	C₇₃H₁₁₄N₈O₁₅
MolecularWeight:	1343.73086

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N(C)C(C(C)C)C(=O)NC(CC(C)C)C(=O)N(C)C(C(=O)OC(C(C)CC)C(=O)N(C)C(C(C)C)C(=O)NC(CC1CCCCC1)C(=O)N(C)C(CC2=CC=CC=C2)C(=O)N3CCCC3C(=O)OCC(=O)C4=CC=CC=C4)C(C)(C)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@H](C(=O)O[C@H](C(C)CC)C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H](CC1CCCCC1)C(=O)N(C)[C@@H](CC2=CC=CC=C2)C(=O)N3CCC[C@H]3C(=O)OCC(=O)C4=CC=CC=C4)C(C)(C)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C73H114N8O15/c1-20-47(9)57(76-71(92)96-72(11,12)13)67(88)78(17)58(45(5)6)62(83)74-52(40-44(3)4)65(86)80(19)61(73(14,15)93)70(91)95-60(48(10)21-2)68(89)79(18)59(46(7)8)63(84)75-53(41-49-32-25-22-26-33-49)64(85)77(16)55(42-50-34-27-23-28-35-50)66(87)81-39-31-38-54(81)69(90)94-43-56(82)51-36-29-24-30-37-51/h23-24,27-30,34-37,44-49,52-55,57-61,93H,20-22,25-26,31-33,38-43H2,1-19H3,(H,74,83)(H,75,84)(H,76,92)/t47-,48?,52+,53+,54+,55+,57+,58+,59+,60-,61-/m1/s1

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