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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP012951

1-O-[(1R,11S,12S,13R,15S)-13-methoxy-5,7,21-trioxa-19-azahexacyclo[11.7.1.02,10.04,8.011,15.015,19]henicosa-2,4(8),9-trien-12-yl] 4-O-methyl (2R)-2-hydroxy-2-(4-methylpentyl)butanedioate

Formula: C29H39NO9  |  Mol. Weight: 545.60 g/mol

IUPAC: 1-O-[(1R,11S,12S,13R,15S)-13-methoxy-5,7,21-trioxa-19-azahexacyclo[11.7.1.02,10.04,8.011,15.015,19]henicosa-2,4(8),9-trien-12-yl] 4-O-methyl (2R)-2-hydroxy-2-(4-methylpentyl)butanedioate

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Overview

Molecular Formula C29H39NO9
Molecular Weight 545.60 g/mol
Canonical SMILES CC(C)CCCC(CC(=O)OC)(C(=O)OC1C2C3=CC4=C(C=C3C5CN6C2(CCC6)CC1(O5)OC)OCO4)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy