Vitas-M small molecule compound
(3S,11E)-16-methoxy-3-methyl-14-(oxiran-2-ylmethoxy)-3,4,5,6,9,10-hexahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione
Catalog ID
STL527380
SMILES COc1cc(OCC2CO2)cc2c1C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2
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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 C22H28O6 MW 388.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28O6/c1-15-7-6-10-17(23)9-5-3-4-8-16-11-18(26-13-19-14-27-19)12-20(25-2)21(16)22(24)28-15/h4,8,11-12,15,19H,3,5-7,9-10,13-14H2,1-2H3/b8-4+/t15-,19?/m0/s1InChIKey
JDBIQBWDWQLNIH-FOQZAZLISA-NSynonyms
(3S11E)16methoxy3methyl14(oxiran2ylmethoxy)3456910hexahydro1H2benzoxacyclotetradecine17(8H)dione
(3SE)16methoxy3methyl14(oxiran2ylmethoxy)3456910hexahydro1Hbenzo(c)(1)oxacyclotetradecine17(8H)dione
(4~(S)12~(E))18methoxy4methyl16(oxiran2ylmethoxy)3oxabicyclo(1240)octadeca1(14)121517tetraene28dione
16397898
COc1cc(OCC2CO2)cc2c1C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2
InChI=1SC22H28O6c115761017(23)95348161118(261319142719)1220(252)21(16)22(24)2815h4811121519H3579101314H212H3b84+t1519?m0s1
MFCD03267835
ZINC000254699609
ZINC000254699610
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