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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP002590

(1R,2S,17R,19R)-12-hydroxy-19-[(Z)-4-hydroxy-3-methylbut-2-enyl]-8,8,21,21-tetramethyl-5-(3-methylbut-2-enyl)-3,7,20-trioxahexacyclo[15.4.1.02,15.02,19.04,13.06,11]docosa-4(13),5,9,11,15-pentaene-14,18-dione

Formula: C33H38O7  |  Mol. Weight: 546.60 g/mol

IUPAC: (1R,2S,17R,19R)-12-hydroxy-19-[(Z)-4-hydroxy-3-methylbut-2-enyl]-8,8,21,21-tetramethyl-5-(3-methylbut-2-enyl)-3,7,20-trioxahexacyclo[15.4.1.02,15.02,19.04,13.06,11]docosa-4(13),5,9,11,15-pentaene-14,18-dione

Overview

Molecular Formula C33H38O7
Molecular Weight 546.60 g/mol
Canonical SMILES CC(=CCC1=C2C(=C(C3=C1OC45C6CC(C=C4C3=O)C(=O)C5(OC6(C)C)CC=C(C)CO)O)C=CC(O2)(C)C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy