Vitas-M small molecule compound
(8xi,9xi,14xi,17xi)-20-methyl-20,21-epoxypregnan-3-one
Catalog ID
STL547402
SMILES O=C1CC[C@]2(C(C1)CCC1C2CC[C@]2(C1CCC2C1(C)OC1)C)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 C22H34O2 MW 330.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H34O2/c1-20-10-8-15(23)12-14(20)4-5-16-17-6-7-19(22(3)13-24-22)21(17,2)11-9-18(16)20/h14,16-19H,4-13H2,1-3H3/t14?,16?,17?,18?,19?,20-,21-,22?/m0/s1InChIKey
NDJUVJCBLCBNQW-NOCAUUBYSA-NSynonyms
(10~(S)13~(S))1013dimethyl17(2methyloxiran2yl)12456789111214151617tetradecahydrocyclopenta(a)phenanthren3one
(10S13S)1013dimethyl17(2methyloxiran2yl)tetradecahydro1Hcyclopenta(a)phenanthren3(2H)one
(8xi9xi14xi17xi)20methyl2021epoxypregnan3one
16395734
InChI=1SC22H34O2c12010815(23)1214(20)4516176719(22(3)132422)21(172)11918(16)20h141619H413H213H3t14?16?17?18?19?202122?m0s1
MFCD01083464
O=C1CC(C@)2(C(C1)CCC1C2CC(C@)2(C1CCC2C1(C)OC1)C)C
ZINC000012656065
ZINC000253499778
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