triamcinolone benetonide

[2-[(1S,2S,4R,8S,9S,11S,12R,13S)-12-fluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] 3-benzamido-2-methylpropanoate

CAS: 31002-79-6

Molecular Formula	`C35H42FNO8`
Molecular Weight	623.7 g/mol
LogP	4.6
Topological Polar Surface Area	128.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	9
Rotatable Bonds	8
Exact Mass	623.2894
Heavy Atoms	45
Complexity	1340.0

Chemical Identifiers

CAS Number	31002-79-6
SMILES	`CC(CNC(=O)C1=CC=CC=C1)C(=O)OCC(=O)C23C(CC4C2(CC(C5(C4CCC6=CC(=O)C=CC65C)F)O)C)OC(O3)(C)C`
InChIKey	`GUYPYYARYIIWJZ-CYEPYHPTSA-N`

📖 Product Overview

triamcinolone benetonide (CAS: 31002-79-6) is a chemical compound with molecular formula C35H42FNO8 and molecular weight 623.7 g/mol. Its IUPAC systematic name is [2-[(1S,2S,4R,8S,9S,11S,12R,13S)-12-fluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] 3-benzamido-2-methylpropanoate. LogP 4.6 Topological Polar Surface Area 128.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 9 Rotatable Bonds 8 Exact Mass 623.2894 Heavy Atoms 45 Complexity 1340.0 InChI Key: GUYPYYARYIIWJZ-CYEPYHPTSA-N. SMILES: CC(CNC(=O)C1=CC=CC=C1)C(=O)OCC(=O)C23C(CC4C2(CC(C5(C4CCC6=CC(=O)C=CC65C)F)O)C)OC(O3)(C)C.

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