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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP017586

[(3S,5S,6S,8S,10S,13S,14S,17S)-6-hydroxy-17-[(2S)-2-hydroxy-6-methyl-4-oxoheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate

Formula: C27H44O7S  |  Mol. Weight: 512.70 g/mol

IUPAC: [(3S,5S,6S,8S,10S,13S,14S,17S)-6-hydroxy-17-[(2S)-2-hydroxy-6-methyl-4-oxoheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate

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Overview

Molecular Formula C27H44O7S
Molecular Weight 512.70 g/mol
Canonical SMILES CC(C)CC(=O)CC(C)(C1CCC2C1(CC=C3C2CC(C4C3(CCC(C4)OS(=O)(=O)O)C)O)C)O

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy