Vitas-M small molecule compound
(8xi,9xi,14xi,16alpha)-17-hydroperoxy-16-methyl-3,20-dioxopregna-1,4-diene-11,21-diyl diacetate
Catalog ID
STL524436
SMILES OO[C@@]1([C@H](C)CC2[C@]1(C)CC(OC(=O)C)C1C2CCC2=CC(=O)C=C[C@]12C)C(=O)COC(=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 C26H34O8 MW 474.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34O8/c1-14-10-20-19-7-6-17-11-18(29)8-9-24(17,4)23(19)21(33-16(3)28)12-25(20,5)26(14,34-31)22(30)13-32-15(2)27/h8-9,11,14,19-21,23,31H,6-7,10,12-13H2,1-5H3/t14-,19?,20?,21?,23?,24+,25+,26+/m1/s1InChIKey
RLPYBDPXYUMMPL-IELGNEEFSA-NSynonyms
(2((10~(R)13~(S)16~(R)17~(R))11acetyloxy17hydroperoxy101316trimethyl3oxo7891112141516octahydro6~(H)cyclopenta(a)phenanthren17yl)2oxoethyl)acetate
(8xi9xi14xi16alpha)17hydroperoxy16methyl320dioxopregna14diene1121diyldiacetate
135638944
2((8S9S10R11S13S14S16R17R)11acetoxy17hydroperoxy101316trimethyl3oxo67891011121314151617dodecahydro3Hcyclopenta(a)phenanthren17yl)2oxoethylacetate
InChI=1SC26H34O8c11410201976171118(29)8924(174)23(19)21(3316(3)28)1225(205)26(143431)22(30)133215(2)27h89111419212331H67101213H215H3t1419?20?21?23?24+25+26+m1s1
MFCD01543696
OO(C@@)1((C@H)(C)C(C@@H)2(C@)1(C)C(C@H)(OC(=O)C)(C@H)1(C@H)2CCC2=CC(=O)C=C(C@)12C)C(=O)COC(=O)C
ZINC001772491805
ZINC001772491808
Check stock
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