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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP027035

(2E)-2-[(1R,3R,5R,10R,14S)-14-hydroxy-3-[(1E,3E)-4-[(1R,2R,5S)-2-hydroxy-5-(2-hydroxypropan-2-yl)-2-methylcyclopentyl]-2-methylbuta-1,3-dienyl]-14-methyl-4,6-dioxatricyclo[8.4.0.01,5]tetradecan-11-ylidene]propanal

Formula: C30H46O6  |  Mol. Weight: 502.70 g/mol

IUPAC: (2E)-2-[(1R,3R,5R,10R,14S)-14-hydroxy-3-[(1E,3E)-4-[(1R,2R,5S)-2-hydroxy-5-(2-hydroxypropan-2-yl)-2-methylcyclopentyl]-2-methylbuta-1,3-dienyl]-14-methyl-4,6-dioxatricyclo[8.4.0.01,5]tetradecan-11-ylidene]propanal

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Overview

Molecular Formula C30H46O6
Molecular Weight 502.70 g/mol
Canonical SMILES CC(=CC1CC23C(CCCOC2O1)C(=C(C)C=O)CCC3(C)O)C=CC4C(CCC4(C)O)C(C)(C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy