Vitas-M small molecule compound
(8xi,9xi,14xi,17xi,19E)-3-(acetyloxy)-5,14-dihydroxy-19-(hydroxyimino)card-20(22)-enolide
Catalog ID
STL525231
SMILES O/N=C/[C@@]12CCC(CC2(O)CCC2C1CC[C@]1(C2(O)CCC1C1=CC(=O)OC1)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 C25H35NO7 MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H35NO7/c1-15(27)33-17-3-8-23(14-26-31)19-4-7-22(2)18(16-11-21(28)32-13-16)6-10-25(22,30)20(19)5-9-24(23,29)12-17/h11,14,17-20,29-31H,3-10,12-13H2,1-2H3/b26-14+/t17?,18?,19?,20?,22-,23+,24?,25?/m1/s1InChIKey
XEZYOTFVCGERLI-MJYJSQLPSA-NSynonyms
((10~(R)13~(R))514dihydroxy10((~(E))hydroxyiminomethyl)13methyl17(5oxo2~(H)furan3yl)23467891112151617dodecahydro1~(H)cyclopenta(a)phenanthren3yl)acetate
(3S5S8R9S10R13R14S17R)514dihydroxy10((E)(hydroxyimino)methyl)13methyl17(5oxo25dihydrofuran3yl)hexadecahydro1Hcyclopenta(a)phenanthren3ylacetate
(8xi9xi14xi17xi19E)3(acetyloxy)514dihydroxy19(hydroxyimino)card20(22)enolide
132286295
InChI=1SC25H35NO7c115(27)33173823(142631)194722(2)18(161121(28)321316)61025(2230)20(19)5924(2329)1217h111417202931H3101213H212H3b2614+t17?18?19?20?2223+24?25?m1s1
MFCD01548187
ON=C(C@@)12CC(C@@H)(C(C@@)2(O)CC(C@@H)2(C@@H)1CC(C@)1((C@)2(O)CC(C@@H)1C1=CC(=O)OC1)C)OC(=O)C
ZINC000033858562
ZINC000888090038
Check stock
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Check stock on Vitas-MAvailable files
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