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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP034668

5-[(1R)-1-[(1S,3R,3aS,7aS)-3a-acetyl-3-hydroxy-7a-methyl-5-propan-2-yl-2,3,6,7-tetrahydro-1H-inden-1-yl]-3-methylbutyl]-2,4,6-trihydroxybenzene-1,3-dicarbaldehyde

Formula: C28H38O7  |  Mol. Weight: 486.60 g/mol

IUPAC: 5-[(1R)-1-[(1S,3R,3aS,7aS)-3a-acetyl-3-hydroxy-7a-methyl-5-propan-2-yl-2,3,6,7-tetrahydro-1H-inden-1-yl]-3-methylbutyl]-2,4,6-trihydroxybenzene-1,3-dicarbaldehyde

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Overview

Molecular Formula C28H38O7
Molecular Weight 486.60 g/mol
Canonical SMILES CC(C)CC(C1CC(C2(C1(CCC(=C2)C(C)C)C)C(=O)C)O)C3=C(C(=C(C(=C3O)C=O)O)C=O)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy