Vitas-M small molecule compound
(8xi,9xi,14xi)-17-oxoandrost-5-en-3-yl pyridine-3-carboxylate
Catalog ID
STL566310
SMILES O=C1CCC2[C@]1(C)CCC1C2CC=C2[C@]1(C)CCC(C2)OC(=O)c1cccnc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C25H31NO3 MW 393.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31NO3/c1-24-11-9-18(29-23(28)16-4-3-13-26-15-16)14-17(24)5-6-19-20-7-8-22(27)25(20,2)12-10-21(19)24/h3-5,13,15,18-21H,6-12,14H2,1-2H3/t18?,19?,20?,21?,24-,25-/m0/s1InChIKey
KNXPPCLGHUVEJL-WFLJIZOKSA-NSynonyms
((10R13S)1013dimethyl17oxo12347891112141516dodecahydrocyclopenta(a)phenanthren3yl)pyridine3carboxylate
(10R13S)1013dimethyl17oxo2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylnicotinate
(8xi9xi14xi)17oxoandrost5en3ylpyridine3carboxylate
16396097
InChI=1SC25H31NO3c12411918(2923(28)164313261516)1417(24)5619207822(27)25(202)121021(19)24h3513151821H61214H212H3t18?19?20?21?2425m0s1
O=C1CCC2(C@)1(C)CCC1C2CC=C2(C@)1(C)CCC(C2)OC(=O)c1cccnc1
ZINC000004026667
ZINC000253499593
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