Vitas-M small molecule compound
4-{[(8xi,9xi,14xi)-17-hydroxy-3,11,20-trioxopregn-4-en-21-yl]oxy}-4-oxobutanoic acid
Catalog ID
STL525162
SMILES OC(=O)CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(=O)C1C2CCC2=CC(=O)CC[C@]12C
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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 C25H32O8 MW 460.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32O8/c1-23-9-7-15(26)11-14(23)3-4-16-17-8-10-25(32,24(17,2)12-18(27)22(16)23)19(28)13-33-21(31)6-5-20(29)30/h11,16-17,22,32H,3-10,12-13H2,1-2H3,(H,29,30)/t16?,17?,22?,23-,24-,25-/m0/s1InChIKey
WVSVAJGDZIWYBX-GPLOUCPESA-NSynonyms
135639026
4(((8xi9xi14xi)17hydroxy31120trioxopregn4en21yl)oxy)4oxobutanoicacid
4(2((10~(R)13~(S)17~(R))17hydroxy1013dimethyl311dioxo12678912141516decahydrocyclopenta(a)phenanthren17yl)2oxoethoxy)4oxobutanoicacid
4(2((8S9S10R13S14S17R)17hydroxy1013dimethyl311dioxo2367891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren17yl)2oxoethoxy)4oxobutanoicacid
InChI=1SC25H32O8c1239715(26)1114(23)34161781025(3224(172)1218(27)22(16)23)19(28)133321(31)6520(29)30h1116172232H3101213H212H3(H2930)t16?17?22?232425m0s1
MFCD01543662
OC(=O)CCC(=O)OCC(=O)(C@@)1(O)CC(C@@H)2(C@)1(C)CC(=O)(C@H)1(C@H)2CCC2=CC(=O)CC(C@)12C
ZINC000040498198
ZINC001772491704
Check stock
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