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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP031257

(1S,12S,13S,16S,18S)-12-[2-(4-hydroxyphenyl)ethyl]-18-methoxy-15-methyl-12-oxido-5,7-dioxa-15-aza-12-azoniapentacyclo[11.7.0.01,16.02,10.04,8]icosa-2,4(8),9,19-tetraen-14-one

Formula: C26H28N2O6  |  Mol. Weight: 464.50 g/mol

IUPAC: (1S,12S,13S,16S,18S)-12-[2-(4-hydroxyphenyl)ethyl]-18-methoxy-15-methyl-12-oxido-5,7-dioxa-15-aza-12-azoniapentacyclo[11.7.0.01,16.02,10.04,8]icosa-2,4(8),9,19-tetraen-14-one

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Overview

Molecular Formula C26H28N2O6
Molecular Weight 464.50 g/mol
Canonical SMILES CN1C2CC(C=CC23C(C1=O)[N+](CC4=CC5=C(C=C34)OCO5)(CCC6=CC=C(C=C6)O)[O-])OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy