Vitas-M small molecule compound
(8xi,9xi,14xi)-11,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl N-(tert-butoxycarbonyl)glycinate
Catalog ID
STL524385
SMILES O=C(CNC(=O)OC(C)(C)C)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(O)C1C2CCC2=CC(=O)C=C[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 C28H39NO8 MW 517.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H39NO8/c1-25(2,3)37-24(34)29-14-22(33)36-15-21(32)28(35)11-9-19-18-7-6-16-12-17(30)8-10-26(16,4)23(18)20(31)13-27(19,28)5/h8,10,12,18-20,23,31,35H,6-7,9,11,13-15H2,1-5H3,(H,29,34)/t18?,19?,20?,23?,26-,27-,28-/m0/s1InChIKey
IACALMMWQADCHJ-PMFUWGDGSA-NSynonyms
(2((10~(R)13~(S)17~(R))1117dihydroxy1013dimethyl3oxo7891112141516octahydro6~(H)cyclopenta(a)phenanthren17yl)2oxoethyl)2((2methylpropan2yl)oxycarbonylamino)acetate
(8xi9xi14xi)1117dihydroxy320dioxopregna14dien21ylN(tertbutoxycarbonyl)glycinate
135638941
2((8S9S10R11S13S14S17R)1117dihydroxy1013dimethyl3oxo67891011121314151617dodecahydro3Hcyclopenta(a)phenanthren17yl)2oxoethyl2((tertbutoxycarbonyl)amino)acetate
InChI=1SC28H39NO8c125(23)3724(34)291422(33)361521(32)28(35)119191876161217(30)81026(164)23(18)20(31)1327(1928)5h810121820233135H679111315H215H3(H2934)t18?19?20?23?262728m0s1
MFCD01546516
O=C(CNC(=O)OC(C)(C)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
ZINC001772491526
ZINC001772491529
Check stock
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Check stock on Vitas-MAvailable files
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