Vitas-M small molecule compound

11,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl acetate

Catalog ID
STL450998
SMILES CC(=O)OCC(=O)C1(O)CCC2C1(C)CC(O)C1C2CCC2=CC(=O)C=CC12C

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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 C23H30O6 MW 402.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h6,8,10,16-18,20,26,28H,4-5,7,9,11-12H2,1-3H3
InChIKey
LRJOMUJRLNCICJ-UHFFFAOYSA-N
Synonyms
52-21-1
(2(1117dihydroxy1013dimethyl3oxo7891112141516octahydro6Hcyclopenta(a)phenanthren17yl)2oxoethyl)acetate
1117dihydroxy320dioxopregna14dien21ylacetate
52211
CC(=O)OCC(=O)C1(CCC2C1(CC(C3C2CCC4=CC(=O)C=CC34C)O)C)O
InChI=1SC23H30O6c113(24)291219(27)23(28)97171654141015(25)6821(142)20(16)18(26)1122(1723)3h68101618202628H45791112H213H3
MFCD00669430
PREDNISOLONE21ACETATE
ZINC000013718974
ZINC000252428550

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Available files

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