Vitas-M small molecule compound
(8xi,9xi,14xi)-17-(phenylcarbonyl)androsta-5,16-dien-3-yl acetate
Catalog ID
STL524782
SMILES CC(=O)OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3CC=C2C(=O)c2ccccc2)C)C1)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 C28H34O3 MW 418.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34O3/c1-18(29)31-21-13-15-27(2)20(17-21)9-10-22-23-11-12-25(28(23,3)16-14-24(22)27)26(30)19-7-5-4-6-8-19/h4-9,12,21-24H,10-11,13-17H2,1-3H3/t21?,22?,23?,24?,27-,28-/m0/s1InChIKey
GUHOJWMKULSAET-UJOLWACXSA-NSynonyms
((10~(R)13~(S))17benzoyl1013dimethyl23478911121415decahydro1~(H)cyclopenta(a)phenanthren3yl)acetate
(10R13S)17benzoyl1013dimethyl234789101112131415dodecahydro1Hcyclopenta(a)phenanthren3ylacetate
(8xi9xi14xi)17(phenylcarbonyl)androsta516dien3ylacetate
16395059
CC(=O)OC1CC(C@)2(C(=CCC3C2CC(C@)2(C3CC=C2C(=O)c2ccccc2)C)C1)C
InChI=1SC28H34O3c118(29)3121131527(2)20(1721)9102223111225(28(233)161424(22)27)26(30)197546819h49122124H10111317H213H3t21?22?23?24?2728m0s1
MFCD01082709
ZINC000252693885
ZINC000253499422
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