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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP010691

Tribulusamide B

Formula: C36H34N2O9  |  Mol. Weight: 638.70 g/mol

IUPAC: (2R,3S)-2-(4-hydroxy-3-methoxyphenyl)-5-[(E)-3-[2-(4-hydroxyphenyl)ethylamino]-3-oxoprop-1-enyl]-N-[2-(4-hydroxyphenyl)-2-oxoethyl]-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxamide

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Overview

Molecular Formula C36H34N2O9
Molecular Weight 638.70 g/mol
Canonical SMILES COC1=CC(=CC2=C1OC(C2C(=O)NCC(=O)C3=CC=C(C=C3)O)C4=CC(=C(C=C4)O)OC)C=CC(=O)NCCC5=CC=C(C=C5)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy