tert-Butyloxycarbonyl-leucyl-alanyl-leucyl-alanyl-leucyl-tryptophan

(2S)-3-(1H-indol-3-yl)-2-[[(2S)-4-methyl-2-[[(2S)-2-[[(2S)-4-methyl-2-[[(2S)-2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]propanoyl]amino]pentanoyl]amino]propanoyl]amino]pentanoyl]amino]propanoic acid

Also Known As: Boclalalw|Boc-leu-ala-leu-ala-leu-trp|tert-Butyloxycarbonyl-leucyl-alanyl-leucyl-alanyl-leucyl-tryptophan|N-(tert-Butoxycarbonyl)-L-leucyl-L-alanyl-L-leucyl-L-alanyl-L-leucyl-L-tryptophan|(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-{[(tert-butoxy)carbonyl]amino}-4-methylpentanamido]propanamido]-4-methylpentanamido]propanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid|(2S)-3-(1H-INDOL-3-YL)-2-[[(2S)-4-METHYL-2-[[(2S)-2-[[(2S)-4-METHYL-2- [[(2S)-2-[[(2S)-4-METHYL-2-(BOC-AMINO)PENTANOYL]AMINO]P ROPANOYL]AMINO]PENTANOYL]AMINO]PROPANOYL]AMINO]PENTANOYL]AMINO]PROPANO IC ACID|(2S)-3-(1H-indol-3-yl)-2-[[(2S)-4-methyl-2-[[(2S)-2-[[(2S)-4-methyl-2-[[(2S)-2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]propanoyl]amino]pentanoyl]amino]propanoyl]amino]pentanoyl]amino]propanoic acid|(6S,9S,12S,15S,18S,21S)-21-((1H-Indol-3-yl)methyl)-6,12,18-triisobutyl-2,2,9,15-tetramethyl-4,7,10,13,16,19-hexaoxo-3-oxa-5,8,11,14,17,20-hexaazadocosan-22-oic acid|-3- -2-[[ -4-methyl-2-[[ -2-[[ -4-methyl-2-[[ -2-[[ -4-methyl-2- pentanoyl]amino]propanoyl]amino]pentanoyl]amino]propanoyl]amino]pentanoyl]amino]propanoicacid

Molecular Formula	C40H63N7O9
Molecular Weight	785.46875 g/mol
LogP	3.2904
Topological Polar Surface Area	236.92 Ų
Hydrogen Bond Donors	8
Hydrogen Bond Acceptors	8
Rotatable Bonds	20
Exact Mass	785.46875
Monoisotopic Mass	785.46875
Heavy Atoms	56
Complexity	1681.0753

Chemical Identifiers

CAS Number	97399-67-2
SMILES	C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C