Vitas-M small molecule compound
(17beta)-17-ethynylestra-1(10),2,4-triene-3,17-diyl diacetate
Catalog ID
STK366237
SMILES C#C[C@@]1(CCC2C1(C)CCC1C2CCc2c1ccc(c2)OC(=O)C)OC(=O)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 C24H28O4 MW 380.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28O4/c1-5-24(28-16(3)26)13-11-22-21-8-6-17-14-18(27-15(2)25)7-9-19(17)20(21)10-12-23(22,24)4/h1,7,9,14,20-22H,6,8,10-13H2,2-4H3/t20?,21?,22?,23?,24-/m0/s1InChIKey
UQWZWQYTKPEDAK-LBXYBUTKSA-NSynonyms
((17R)17acetyloxy17ethynyl13methyl7891112141516octahydro6Hcyclopenta(a)phenanthren3yl)acetate
(13S17R)17ethynyl13methyl78911121314151617decahydro6Hcyclopenta(a)phenanthrene317diyldiacetate
(17beta)17ethynylestra1(10)24triene317diyldiacetate
C#C(C@@)1(CCC2(C@)1(C)CCC1C2CCc2c1ccc(c2)OC(=O)C)OC(=O)C
C#C(C@@)1(CCC2C1(C)CCC1C2CCc2c1ccc(c2)OC(=O)C)OC(=O)C
CC(=O)OC1=CC2=C(C=C1)C3CCC4(C(C3CC2)CCC4(C#C)OC(=O)C)C
InChI=1SC24H28O4c1524(2816(3)26)1311222186171418(2715(2)25)7919(17)20(21)101223(2224)4h179142022H681013H224H3t20?21?22?23?24m0s1
MFCD00356188
ZINC000004014902
ZINC000004025767
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