Compound BIMP027810

cyclo[DL-Ala-DL-xiIle-Gly-DL-Cys(1)-DL-Ser-DL-Cys(2)-DL-Lys-DL-Ser-DL-Lys-DL-Val-DL-Cys(3)-DL-Tyr-DL-Arg-DL-Asn-Gly-DL-xiIle-DL-Pro-DL-Cys(1)-Gly-DL-Glu-DL-Ser-DL-Cys(2)-DL-Val-DL-Trp-DL-xiIle-DL-Pro-DL-Cys(3)-DL-xiIle-DL-Ser-DL-Ser]

Formula: C₁₃₃H₂₀₇N₃₇O₃₉S₆ | Mol. Weight: 3140.70 g/mol

IUPAC: 3-[43,49-bis(4-aminobutyl)-28-(2-amino-2-oxoethyl)-22,64,76,88-tetra(butan-2-yl)-31-(3-carbamimidamidopropyl)-4,46,55,70,73-pentakis(hydroxymethyl)-34-[(4-hydroxyphenyl)methyl]-91-(1H-indol-3-ylmethyl)-67-methyl-3,6,9,12,15,21,24,27,30,33,36,39,42,45,48,51,54,57,60,63,66,69,72,75,78,81,87,90,93,96-triacontaoxo-40,94-di(propan-2-yl)-2a,3a,6a,7a,98,99-hexathia-2,5,8,11,14,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62,65,68,71,74,77,80,86,89,92,95-triacontazahexacyclo[50.44.4.413,58.437,79.016,20.082,86]octahectan-7-yl]propanoic acid

3D View Find Similar

Overview

Molecular Formula C₁₃₃H₂₀₇N₃₇O₃₉S₆

Molecular Weight 3140.70 g/mol

Canonical SMILES

CCC(C)C1C(=O)NCC(=O)NC2CSSCC3C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC4CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)C)CO)CO)C(C)CC)NC(=O)C5CCCN5C(=O)C(NC(=O)C(NC(=O)C(NC4=O)C(C)C)CC6=CNC7=CC=CC=C76)C(C)CC)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)N8CCCC8C(=O)N3)C(C)CC)CC(=O)N)CCCNC(=N)N)CC9=CC=C(C=C9)O)C(C)C)CCCCN)CO)CCCCN)NC(=O)C(NC2=O)CO)CO)CCC(=O)O

Bioactivity of Indian Medicinal Plants

cyclo[DL-Ala-DL-xiIle-Gly-DL-Cys(1)-DL-Ser-DL-Cys(2)-DL-Lys-DL-Ser-DL-Lys-DL-Val-DL-Cys(3)-DL-Tyr-DL-Arg-DL-Asn-Gly-DL-xiIle-DL-Pro-DL-Cys(1)-Gly-DL-Glu-DL-Ser-DL-Cys(2)-DL-Val-DL-Trp-DL-xiIle-DL-Pro-DL-Cys(3)-DL-xiIle-DL-Ser-DL-Ser]

Overview

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy

Jump To: