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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP026895

erythro-(7R,8S)-Dadahol B

Formula: C38H36O11  |  Mol. Weight: 668.70 g/mol

IUPAC: [(E)-3-[4-[(1R,2S)-1-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxypropan-2-yl]oxy-3-methoxyphenyl]prop-2-enyl] (E)-3-(4-hydroxyphenyl)prop-2-enoate

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Overview

Molecular Formula C38H36O11
Molecular Weight 668.70 g/mol
Canonical SMILES COC1=C(C=CC(=C1)C=CCOC(=O)C=CC2=CC=C(C=C2)O)OC(COC(=O)C=CC3=CC=C(C=C3)O)C(C4=CC(=C(C=C4)O)OC)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy