Vitas-M small molecule compound
(8xi,9xi,14xi)-17-{[(4-methylphenyl)sulfonyl]oxy}androst-5-en-3-yl acetate
Catalog ID
STL525471
SMILES CC(=O)OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3CCC2OS(=O)(=O)c2ccc(cc2)C)C)C1)C
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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 C28H38O5S MW 486.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H38O5S/c1-18-5-8-22(9-6-18)34(30,31)33-26-12-11-24-23-10-7-20-17-21(32-19(2)29)13-15-27(20,3)25(23)14-16-28(24,26)4/h5-9,21,23-26H,10-17H2,1-4H3/t21?,23?,24?,25?,26?,27-,28-/m0/s1InChIKey
VHSUWQHYYVDVEW-BWYMCPLZSA-NSynonyms
((10~(R)13~(S))1013dimethyl17(4methylphenyl)sulfonyloxy234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3yl)acetate
(8R9R10R13S17S)1013dimethyl17(tosyloxy)2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylacetate
(8xi9xi14xi)17(((4methylphenyl)sulfonyl)oxy)androst5en3ylacetate
16396229
CC(=O)OC1CC(C@)2(C(=CC(C@@H)3(C@H)2CC(C@)2(C3CC(C@@H)2OS(=O)(=O)c2ccc(cc2)C)C)C1)C
InChI=1SC28H38O5Sc1185822(9618)34(3031)332612112423107201721(3219(2)29)131527(203)25(23)141628(2426)4h59212326H1017H214H3t21?23?24?25?26?2728m0s1
MFCD01548232
ZINC000253500051
ZINC000253500054
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