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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP023960

2'-Apo-beta-carotenal

Formula: C37H48O  |  Mol. Weight: 508.80 g/mol

IUPAC: (2Z,4Z,6Z,8E,10E,12E,14Z,16E,18E,20Z,22E)-4,8,12,17,21-pentamethyl-23-(2,6,6-trimethylcyclohexen-1-yl)tricosa-2,4,6,8,10,12,14,16,18,20,22-undecaenal

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Overview

Molecular Formula C37H48O
Molecular Weight 508.80 g/mol
Canonical SMILES CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CC=O)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy