Vitas-M small molecule compound
(8xi,14xi)-9-fluoro-11-hydroxy-3,20-dioxopregna-1,4,16-trien-21-yl propanoate
Catalog ID
STL565955
SMILES CCC(=O)OCC(=O)C1=CCC2[C@]1(C)CC(O)[C@]1(C2CCC2=CC(=O)C=C[C@]12C)F
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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 C24H29FO5 MW 416.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29FO5/c1-4-21(29)30-13-19(27)18-8-7-16-17-6-5-14-11-15(26)9-10-23(14,3)24(17,25)20(28)12-22(16,18)2/h8-11,16-17,20,28H,4-7,12-13H2,1-3H3/t16?,17?,20?,22-,23-,24-/m0/s1InChIKey
VGZRXZORRFZAKE-UKZHJPNGSA-NSynonyms
(2((9R10S13S)9fluoro11hydroxy1013dimethyl3oxo7811121415hexahydro6Hcyclopenta(a)phenanthren17yl)2oxoethyl)propanoate
(8xi14xi)9fluoro11hydroxy320dioxopregna1416trien21ylpropanoate
16399371
2((9R10S13S)9fluoro11hydroxy1013dimethyl3oxo6789101112131415decahydro3Hcyclopenta(a)phenanthren17yl)2oxoethylpropionate
CCC(=O)OCC(=O)C1=CCC2(C@)1(C)CC(O)(C@)1(C2CCC2=CC(=O)C=C(C@)12C)F
InChI=1SC24H29FO5c1421(29)301319(27)1887161765141115(26)91023(143)24(1725)20(28)1222(1618)2h81116172028H471213H213H3t16?17?20?222324m0s1
ZINC000070681107
ZINC000253498779
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