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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP023691

Hordatine B glucoside

Formula: C35H50N8O10  |  Mol. Weight: 742.80 g/mol

IUPAC: N-[4-(diaminomethylideneamino)butyl]-5-[(Z)-3-[4-(diaminomethylideneamino)butylamino]-3-oxoprop-1-enyl]-7-methoxy-2-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2,3-dihydro-1-benzofuran-3-carboxamide

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Overview

Molecular Formula C35H50N8O10
Molecular Weight 742.80 g/mol
Canonical SMILES COC1=CC(=CC2=C1OC(C2C(=O)NCCCCN=C(N)N)C3=CC=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O)C=CC(=O)NCCCCN=C(N)N

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy