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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP013120

Hibispeptin A

Formula: C39H50N6O8  |  Mol. Weight: 730.80 g/mol

IUPAC: (2S)-N-[(10S,13S,16S)-16-benzyl-3-ethyl-24-hydroxy-13-(2-methylpropyl)-5,11,14,17,20-pentaoxo-6,12,15,18-tetrazatricyclo[19.3.1.06,10]pentacosa-1(24),21(25),22-trien-4-yl]-5-oxopyrrolidine-2-carboxamide

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Overview

Molecular Formula C39H50N6O8
Molecular Weight 730.80 g/mol
Canonical SMILES CCC1CC2=C(C=CC(=C2)C(=O)CNC(=O)C(NC(=O)C(NC(=O)C3CCCN3C(=O)C1NC(=O)C4CCC(=O)N4)CC(C)C)CC5=CC=CC=C5)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy