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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP005229

[(1S,2R,3R,4S,5R,6S,8R,9S,10S,13S,16S,17R,18S)-4-acetyloxy-8,9-dihydroxy-6,16,18-trimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadec-11-en-13-yl]methyl 2-acetamidobenzoate

Formula: C33H42N2O10  |  Mol. Weight: 626.70 g/mol

IUPAC: [(1S,2R,3R,4S,5R,6S,8R,9S,10S,13S,16S,17R,18S)-4-acetyloxy-8,9-dihydroxy-6,16,18-trimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadec-11-en-13-yl]methyl 2-acetamidobenzoate

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Overview

Molecular Formula C33H42N2O10
Molecular Weight 626.70 g/mol
Canonical SMILES CC(=O)NC1=CC=CC=C1C(=O)OCC23CCC(C45C2C(C(C4N=C3)(C6(CC(C7CC5C6C7OC(=O)C)OC)O)O)OC)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy