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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP016545

Complanadine B

Formula: C32H40N4O  |  Mol. Weight: 496.70 g/mol

IUPAC: (1R,9R,10R,16R)-16-methyl-5-[(1R,9S,10R,16R)-16-methyl-6,14-diazatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-yl]-6,14-diazatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-8-one

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Overview

Molecular Formula C32H40N4O
Molecular Weight 496.70 g/mol
Canonical SMILES CC1CC2CC3=C(C=C(C=N3)C4=NC5=C(C=C4)C67CC(CC(C6CCCN7)C5=O)C)C8(C1)C2CCCN8

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy