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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP007812

cyclo[Gly-Pro-Pro-Pro-Tyr-Pro-Pro-Met-Ile]

Formula: C47H67N9O10S  |  Mol. Weight: 950.20 g/mol

IUPAC: (1S,7S,13S,16S,22S,28S,31S,34S)-34-[(2S)-butan-2-yl]-16-[(4-hydroxyphenyl)methyl]-31-(2-methylsulfanylethyl)-3,9,15,18,24,30,33,36,39-nonazahexacyclo[37.3.0.03,7.09,13.018,22.024,28]dotetracontane-2,8,14,17,23,29,32,35,38-nonone

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Overview

Molecular Formula C47H67N9O10S
Molecular Weight 950.20 g/mol
Canonical SMILES CCC(C)C1C(=O)NCC(=O)N2CCCC2C(=O)N3CCCC3C(=O)N4CCCC4C(=O)NC(C(=O)N5CCCC5C(=O)N6CCCC6C(=O)NC(C(=O)N1)CCSC)CC7=CC=C(C=C7)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy