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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012082

cyclo[Ala-Pro-Trp-Val-Trp-Leu-Pro-Trp]

Formula: C57H69N11O8  |  Mol. Weight: 1036.20 g/mol

IUPAC: (3S,6S,9S,15S,18S,21S,24S,27S)-6,18,24-tris(1H-indol-3-ylmethyl)-3-methyl-15-(2-methylpropyl)-21-propan-2-yl-1,4,7,13,16,19,22,25-octazatricyclo[25.3.0.09,13]triacontane-2,5,8,14,17,20,23,26-octone

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Overview

Molecular Formula C57H69N11O8
Molecular Weight 1036.20 g/mol
Canonical SMILES CC1C(=O)N2CCCC2C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N3CCCC3C(=O)NC(C(=O)N1)CC4=CNC5=CC=CC=C54)CC(C)C)CC6=CNC7=CC=CC=C76)C(C)C)CC8=CNC9=CC=CC=C98

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy