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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP036420

7-[(E)-5-[(1S,2R,4aS,8aR)-4a-hydroxy-1,2,5,5-tetramethyl-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-3-methylpent-2-enyl]-2,3-dimethylpurin-6-one

Formula: C27H42N4O2  |  Mol. Weight: 454.60 g/mol

IUPAC: 7-[(E)-5-[(1S,2R,4aS,8aR)-4a-hydroxy-1,2,5,5-tetramethyl-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-3-methylpent-2-enyl]-2,3-dimethylpurin-6-one

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Overview

Molecular Formula C27H42N4O2
Molecular Weight 454.60 g/mol
Canonical SMILES CC1CCC2(C(C1(C)CCC(=CCN3C=NC4=C3C(=O)N=C(N4C)C)C)CCCC2(C)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy