(1S,2S,4R,8S,9S,11S,12R,13S)-8-acetyl-12-bromo-11-hydroxy-6,9,13-trimethyl-5-oxa-7-azapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosa-6,14,17-trien-16-one | C23H28BrNO4 | CC(=O)[C@@]12N=C(C)O[C@@H]1C[C@H]1[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(Br)[C@@H](O)C[C@]21C | B219780 | Chemspace

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Home CSCS06359897750

Structure Info

Chemspace ID: CSCS06359897750 (Synthesis)

IUPAC Name: (1S,2S,4R,8S,9S,11S,12R,13S)-8-acetyl-12-bromo-11-hydroxy-6,9,13-trimethyl-5-oxa-7-azapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosa-6,14,17-trien-16-one

Mol formula: C₂₃H₂₈BrNO₄

Mol weight: 462 Da

Catalog Number(s): B219780

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INCHI
INCHI key
MOL

Properties
SDS

Properties

LogP: 2.87

Heavy atoms count: 29

Rotatable bond count: 1

Number of rings: 5

Carbon bond saturation, Fsp3: 0.695

Polar surface area (Å): 76

Hydrogen bond acceptors count: 4

Hydrogen bond donors count: 1

: Zoom the structure; CSCS06359897750

Items Overall 1 item from 1 supplier

Supplier	Lead time	Ships from	Purity	Pack	Price, €	Qty
Toronto Research Chemicals	50 days	Canada To:	90	50 mg	8,896	Go to cart Enquire
Description: 9alpha-Bromo-21-deacetoxy Deflazacort; CAS: 19888-63-2

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