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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP024118

5,8-Epoxy-5,8-dihydro-b,b-carotene-3,3'-diol

Formula: C40H56O3  |  Mol. Weight: 584.90 g/mol

IUPAC: 2-[(2E,4E,6E,8E,10E,12E,14E,16Z)-17-(4-hydroxy-2,6,6-trimethylcyclohexen-1-yl)-6,11,15-trimethylheptadeca-2,4,6,8,10,12,14,16-octaen-2-yl]-4,4,7a-trimethyl-2,5,6,7-tetrahydro-1-benzofuran-6-ol

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Overview

Molecular Formula C40H56O3
Molecular Weight 584.90 g/mol
Canonical SMILES CC1=C(C(CC(C1)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C2C=C3C(CC(CC3(O2)C)O)(C)C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy