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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP082138

leukotriene C4

Formula: C30H47N3O9S  |  Mol. Weight: 625.80 g/mol

IUPAC: (5S,6R,7E,9E,11Z,14Z)-6-[(2R)-2-[[(4S)-4-amino-4-carboxybutanoyl]amino]-3-(carboxymethylamino)-3-oxopropyl]sulfanyl-5-hydroxyicosa-7,9,11,14-tetraenoic acid

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Overview

Molecular Formula C30H47N3O9S
Molecular Weight 625.80 g/mol
Canonical SMILES CCCCCC=CCC=CC=CC=CC(C(CCCC(=O)O)O)SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy

Therapeutics & Targets

Disease Associations