Org 20599 , CAS No.156685-94-8

Item Number
O287142
Grouped product items
SKUSizeAvailabilityPrice Qty
O287142-10mg
10mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$144.90
O287142-50mg
50mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$603.90

Positive allosteric modulator of GABAAreceptors; direct agonist at higher concentrations

Basic Description

Synonyms2-Chloro-1-[(1S,3aS,3bR,5aS,7S,8S,9aS,9bS,11aS)-7-hydroxy-9a,11a-dimethyl-8-(4-morpholinyl)hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]ethanone | AKOS024457271 | HY-103498 | org20599 | ORG 20599 | CS-0028000 | (2beta,3alpha,5alpha)-21-chloro-3-hydroxy-
Biochemical and Physiological MechanismsPositive allosteric modulator and at higher concentrations direct agonist of GABAAreceptors (EC50= 1.1μM). Also displays positive modulation of glycine receptors (EC50= 22.9μM). Anesthetic steroid; induces hypnosis and loss of righting reflexes in mice.
Storage TempRoom temperature
Shipped InNormal

Associated Targets(non-human)

Mus musculus (284745 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID

Mechanisms of Action

Mechanism of ActionAction Typetarget IDTarget NameTarget TypeTarget OrganismBinding Site NameReferences

Names and Identifiers

IUPAC Name 2-chloro-1-[(2S,3S,5S,8R,9S,10S,13S,14S,17S)-3-hydroxy-10,13-dimethyl-2-morpholin-4-yl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanone
INCHI InChI=1S/C25H40ClNO3/c1-24-8-7-19-17(18(24)5-6-20(24)23(29)15-26)4-3-16-13-22(28)21(14-25(16,19)2)27-9-11-30-12-10-27/h16-22,28H,3-15H2,1-2H3/t16-,17-,18-,19-,20+,21-,22-,24-,25-/m0/s1
InChi Key NZFNABGZEQPYBX-PMBZPZLSSA-N
Canonical SMILES CC12CCC3C(C1CCC2C(=O)CCl)CCC4C3(CC(C(C4)O)N5CCOCC5)C
Isomeric SMILES C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)CCl)CC[C@@H]4[C@@]3(C[C@@H]([C@H](C4)O)N5CCOCC5)C
PubChem CID 9850026
Molecular Weight 438.04

Certificates

Certificate of Analysis(COA)

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Chemical and Physical Properties

SolubilitySolvent:1eq. HCl, Max Conc. mg/mL: 43.8, Max Conc. mM: 100; Solvent:DMSO, Max Conc. mg/mL: 43.8, Max Conc. mM: 100

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Solution Calculators