CAS 1058-04-4 (16Alpha)-21-(Acetyloxy)-17-hydroxy-16-methyl-pregna-1,4-diene-3,11,20-trione

CAT	APS1058044
CAS	1058-04-4
Synonyms	17,21-Dihydroxy-16α-methyl-pregna-1,4-diene-3,11,20-trione 21-Acetate
IUPAC Name	[2-[(8S,9S,10R,13S,14S,16R,17R)-17-hydroxy-10,13,16-trimethyl-3,11-dioxo-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] acetate
Molecular Weight	414.49
Molecular Formula	C24H30O6
Canonical SMILES	C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@H]3C(=O)C[C@]2(C)[C@@]1(O)C(=O)COC(=O)C
InChI	InChI=1S/C24H30O6/c1-13-9-18-17-6-5-15-10-16(26)7-8-22(15,3)21(17)19(27)11-23(18,4)24(13,29)20(28)12-30-14(2)25/h7-8,10,13,17-18,21,29H,5-6,9,11-12H2,1-4H3/t13-,17+,18+,21-,22+,23+,24+/m1/s1

Accurate Mass	414.2042
Format	Neat
Subcategory	Steroids and derivatives, Dexamethasone and derivatives

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