Vitas-M small molecule compound
(8xi,9xi,14xi)-3-oxoandrost-4-en-17-yl benzoate
Catalog ID
STL524958
SMILES O=C1CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2OC(=O)c1ccccc1)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 C26H32O3 MW 392.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32O3/c1-25-14-12-19(27)16-18(25)8-9-20-21-10-11-23(26(21,2)15-13-22(20)25)29-24(28)17-6-4-3-5-7-17/h3-7,16,20-23H,8-15H2,1-2H3/t20?,21?,22?,23?,25-,26-/m0/s1InChIKey
RZJSCADWIWNGKI-RVLDYFFOSA-NSynonyms
((10~(R)13~(S))1013dimethyl3oxo126789111214151617dodecahydrocyclopenta(a)phenanthren17yl)benzoate
(10R13S)1013dimethyl3oxo2367891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren17ylbenzoate
(8xi9xi14xi)3oxoandrost4en17ylbenzoate
16395376
InChI=1SC26H32O3c125141219(27)1618(25)892021101123(26(212)151322(20)25)2924(28)176435717h37162023H815H212H3t20?21?22?23?2526m0s1
MFCD01544766
O=C1CC(C@)2(C(=C1)CCC1C2CC(C@)2(C1CCC2OC(=O)c1ccccc1)C)C
ZINC000004024410
ZINC000253499957
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