Vitas-M small molecule compound

(8xi,9xi,10xi,13xi,14xi)-17,21-dihydroxypregn-4-ene-3,20-dione

Catalog ID
STK764479
SMILES OCC(=O)[C@@]1(O)CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12C

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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 C21H30O4 MW 346.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3/t15?,16?,17?,19?,20?,21-/m0/s1
InChIKey
WHBHBVVOGNECLV-VLAJLFEZSA-N
Synonyms
152-58-9
(17R)17hydroxy17(2hydroxyacetyl)1013dimethyl267891112141516decahydro1Hcyclopenta(a)phenanthren3one
(8xi9xi10xi13xi14xi)1721dihydroxypregn4ene320dione
11DEOXY17HYDROXYCORTICOSTERONE
11DESOXY17HYDROXYCORTICOSTERONE
11DIOXYCORTISOL
152589
17ALPHAHYDROXYCORTEXONE
17HYDROXY11DEOXYCORTICOSTERONE
4PREGNENE17ALPHA21DIOL320DIONE
CC12CCC(=O)C=C1CCC3C2CCC4(C3CCC4(C(=O)CO)O)C
CORTODOXONE(USANINNBAN)
InChI=1SC21H30O4c1198514(23)1113(19)341516(19)6920(2)17(15)71021(2025)18(24)1222h1115172225H31012H212H3t15?16?17?19?20?21m0s1
MFCD00377927
OCC(=O)(C@@)1(O)CCC2C1(C)CCC1C2CCC2=CC(=O)CCC12C
REICHSTEINSCOMPOUNDS
SUBSTANCES
ZINC000003860956
ZINC000253507425

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Available files

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