(22S)-BUDESONIDE

(1S,2S,4R,6S,8S,9S,11S,12S,13R)-11-hydroxy-8-(2-hydroxyacetyl)-9,13-dimethyl-6-propyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one

CAS: 51372-28-2

Molecular Formula	`C25H34O6`
Molecular Weight	430.5 g/mol
LogP	2.5
Topological Polar Surface Area	93.1 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	430.23553
Heavy Atoms	31
Complexity	862.0

Chemical Identifiers

CAS Number	51372-28-2
SMILES	`CCCC1OC2CC3C4CCC5=CC(=O)C=CC5(C4C(CC3(C2(O1)C(=O)CO)C)O)C`
InChIKey	`VOVIALXJUBGFJZ-AMTWPJRWSA-N`

📖 Product Overview

(22S)-BUDESONIDE (CAS: 51372-28-2) is a chemical compound with molecular formula C25H34O6 and molecular weight 430.5 g/mol. Its IUPAC systematic name is (1S,2S,4R,6S,8S,9S,11S,12S,13R)-11-hydroxy-8-(2-hydroxyacetyl)-9,13-dimethyl-6-propyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-16-one. LogP 2.5 Topological Polar Surface Area 93.1 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 4 Exact Mass 430.23553 Heavy Atoms 31 Complexity 862.0 InChI Key: VOVIALXJUBGFJZ-AMTWPJRWSA-N. SMILES: CCCC1OC2CC3C4CCC5=CC(=O)C=CC5(C4C(CC3(C2(O1)C(=O)CO)C)O)C.

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