Nicocortonide

Nicocortonide
Clinical data
Other names	11β,14α,17α,21-Tetrahydroxypregn-4-ene-3,20-dione cyclic 14,17-acetal with crotonaldehyde, 21-isonicotinate; 11β,21-Dihydroxy-14α,17α-(1-propenylmethylendioxy)pregn-4-ene-3,20-dione 21-isonicotinate
Drug class	Corticosteroid; Glucocorticoid
Identifiers
	IUPAC name 2-{(1R,2R,10R,11S,12S,14S,15R)-12-Hydroxy-10,14-dimethyl-7-oxo-17-[(1Z)-1-propen-1-yl]-16,18-dioxapentacyclo[13.3.2.01,14.02,11.05,10]icos-5-en-15-yl}-2-oxoethyl isonicotinate;
CAS Number	65415-41-0;
PubChem CID	70687284;
ChemSpider	4940815;
UNII	341BNG318Y;
ChEMBL	ChEMBL2106447;
ECHA InfoCard	100.059.759
Chemical and physical data
Formula	C31H37NO7
Molar mass	535.637 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES C/C=C/C1O[C@@]23CC[C@]([C@]2(C[C@@H]([C@H]4[C@H]3CCC5=CC(=O)CC[C@]45C)O)C)(O1)C(=O)COC(=O)C6=CN=CC=C6;
	InChI InChI=1S/C31H37NO7/c1-4-6-25-38-30-12-13-31(39-25,24(35)18-37-27(36)19-7-5-14-32-17-19)29(30,3)16-23(34)26-22(30)9-8-20-15-21(33)10-11-28(20,26)2/h4-7,14-15,17,22-23,25-26,34H,8-13,16,18H2,1-3H3/b6-4+/t22-,23+,25?,26-,28+,29+,30-,31+/m1/s1; Key:NAXHODQTSUXYNT-VOHINOEZSA-N;

Nicocortonide is a synthetic glucocorticoid corticosteroid which was never marketed.^[1]

References

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