Vitas-M small molecule compound
(8xi,9xi,14xi,17alpha)-11,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl 4-[(2,5-dioxopyrrolidin-1-yl)oxy]-4-oxobutanoate
Catalog ID
STL526510
SMILES O=C(OCC(=O)[C@]1(O)CCC2[C@]1(C)CC(O)C1C2CCC2=CC(=O)C=C[C@]12C)CCC(=O)ON1C(=O)CCC1=O
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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 C29H35NO10 MW 557.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H35NO10/c1-27-11-9-17(31)13-16(27)3-4-18-19-10-12-29(38,28(19,2)14-20(32)26(18)27)21(33)15-39-24(36)7-8-25(37)40-30-22(34)5-6-23(30)35/h9,11,13,18-20,26,32,38H,3-8,10,12,14-15H2,1-2H3/t18?,19?,20?,26?,27-,28-,29+/m0/s1InChIKey
SZMXBLNRSKSXJT-PFCMTCLOSA-NSynonyms
(8xi9xi14xi17alpha)1117dihydroxy320dioxopregna14dien21yl4((25dioxopyrrolidin1yl)oxy)4oxobutanoate
1~(O)(2((10~(R)13~(S)17~(S))1117dihydroxy1013dimethyl3oxo7891112141516octahydro6~(H)cyclopenta(a)phenanthren17yl)2oxoethyl)4~(O)(25dioxopyrrolidin1yl)butanedioate
2((8S9S10R11S13S14S17R)1117dihydroxy1013dimethyl3oxo67891011121314151617dodecahydro3Hcyclopenta(a)phenanthren17yl)2oxoethyl(25dioxopyrrolidin1yl)succinate
44666360
InChI=1SC29H35NO10c12711917(31)1316(27)341819101229(3828(192)1420(32)26(18)27)21(33)153924(36)7825(37)403022(34)5623(30)35h911131820263238H3810121415H212H3t18?19?20?26?272829+m0s1
MFCD02926198
O=C(OCC(=O)(C@@)1(O)CC(C@@H)2(C@)1(C)C(C@H)(O)(C@H)1(C@H)2CCC2=CC(=O)C=C(C@)12C)CCC(=O)ON1C(=O)CCC1=O
ZINC000253502385
ZINC000253502393
Check stock
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