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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP018396

[(1S,3R,18S,19R,20R,21R,22S,23S,24R,25R,26S)-19,20,22,23-tetraacetyloxy-21-(acetyloxymethyl)-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-9-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-25-yl] dodecanoate

Formula: C48H67NO18  |  Mol. Weight: 946.00 g/mol

IUPAC: [(1S,3R,18S,19R,20R,21R,22S,23S,24R,25R,26S)-19,20,22,23-tetraacetyloxy-21-(acetyloxymethyl)-26-hydroxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-9-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-25-yl] dodecanoate

Overview

Molecular Formula C48H67NO18
Molecular Weight 946.00 g/mol
Canonical SMILES CCCCCCCCCCCC(=O)OC1C2C(C(C3(C14C(C(C(C3OC(=O)C)OC(=O)C)OC(=O)C(CCC5=C(C=NC=C5)C(=O)OCC2(O4)C)C)(C)O)COC(=O)C)OC(=O)C)OC(=O)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy