Vitas-M small molecule compound
(8xi,9xi,14xi)-17-oxoandrost-5-en-3-yl 3-(pyrrolidin-1-yl)propanoate
Catalog ID
STL526660
SMILES O=C(OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3CCC2=O)C)C1)C)CCN1CCCC1
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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 C26H39NO3 MW 413.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H39NO3/c1-25-12-9-19(30-24(29)11-16-27-14-3-4-15-27)17-18(25)5-6-20-21-7-8-23(28)26(21,2)13-10-22(20)25/h5,19-22H,3-4,6-17H2,1-2H3/t19?,20?,21?,22?,25-,26-/m0/s1InChIKey
HKTXNASFTOEERZ-CYABYPLBSA-NSynonyms
((10~(R)13~(S))1013dimethyl17oxo12347891112141516dodecahydrocyclopenta(a)phenanthren3yl)3pyrrolidin1ylpropanoate
(3S8R9S10R13S14S)1013dimethyl17oxo2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3yl3(pyrrolidin1yl)propanoatehydrochloride
(8xi9xi14xi)17oxoandrost5en3yl3(pyrrolidin1yl)propanoate
135639184
InChI=1SC26H39NO3c12512919(3024(29)11162714341527)1718(25)5620217823(28)26(212)131022(20)25h51922H34617H212H3t19?20?21?22?2526m0s1
MFCD03005884
O=C(O(C@H)1CC(C@)2(C(=CC(C@@H)3(C@@H)2CC(C@)2((C@H)3CCC2=O)C)C1)C)CCN1CCCC1Cl
ZINC000005748809
ZINC001772492412
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