16-OE-3-S

[(8R,9S,13S,14S,17R)-17-hydroxy-13-methyl-16-oxo-7,8,9,11,12,14,15,17-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate

CAS: 17916-85-7

Molecular Formula	`C18H22O6S`
Molecular Weight	366.4 g/mol
LogP	2.3
Topological Polar Surface Area	109.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	2
Exact Mass	366.1137
Heavy Atoms	25
Complexity	655.0

Chemical Identifiers

CAS Number	17916-85-7
SMILES	`CC12CCC3C(C1CC(=O)C2O)CCC4=C3C=CC(=C4)OS(=O)(=O)O`
InChIKey	`QJFFNUBKYWXXCO-YONAWACDSA-N`

📖 Product Overview

16-OE-3-S (CAS: 17916-85-7) is a chemical compound with molecular formula C18H22O6S and molecular weight 366.4 g/mol. Its IUPAC systematic name is [(8R,9S,13S,14S,17R)-17-hydroxy-13-methyl-16-oxo-7,8,9,11,12,14,15,17-octahydro-6H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate. LogP 2.3 Topological Polar Surface Area 109.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 2 Exact Mass 366.1137 Heavy Atoms 25 Complexity 655.0 InChI Key: QJFFNUBKYWXXCO-YONAWACDSA-N. SMILES: CC12CCC3C(C1CC(=O)C2O)CCC4=C3C=CC(=C4)OS(=O)(=O)O.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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