Vitas-M small molecule compound
(8xi,14xi,17alpha)-9,17-dihydroxy-3-oxoandrost-4-ene-17-carbonitrile
Catalog ID
STL524495
SMILES N#C[C@@]1(O)CCC2[C@]1(C)CC[C@]1(C2CCC2=CC(=O)CC[C@]12C)O
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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 C20H27NO3 MW 329.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27NO3/c1-17-7-5-14(22)11-13(17)3-4-16-15-6-8-19(23,12-21)18(15,2)9-10-20(16,17)24/h11,15-16,23-24H,3-10H2,1-2H3/t15?,16?,17-,18-,19-,20+/m0/s1InChIKey
UHCRRDZEBITSMZ-GJTWTXHOSA-NSynonyms
(8xi14xi17alpha)917dihydroxy3oxoandrost4ene17carbonitrile
(9~(R)10~(S)13~(S)17~(R))917dihydroxy1013dimethyl3oxo126781112141516decahydrocyclopenta(a)phenanthrene17carbonitrile
(9R10S13S17R)917dihydroxy1013dimethyl3oxo2367891011121314151617tetradecahydro1Hcyclopenta(a)phenanthrene17carbonitrile
16395641
InChI=1SC20H27NO3c1177514(22)1113(17)3416156819(231221)18(152)91020(1617)24h1115162324H310H212H3t15?16?17181920+m0s1
MFCD01545807
N#C(C@@)1(O)CCC2(C@)1(C)CC(C@)1(C2CCC2=CC(=O)CC(C@)12C)O
ZINC000070665290
ZINC000070665295
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