Vitas-M small molecule compound
N-(3-fluorophenyl)-2-{[(3S)-14-methoxy-3-methyl-1,7-dioxo-3,4,5,6,7,8,9,10,11,12-decahydro-1H-2-benzoxacyclotetradecin-16-yl]oxy}acetamide
Catalog ID
STL530840
SMILES COc1cc(OCC(=O)Nc2cccc(c2)F)c2c(c1)CCCCCC(=O)CCC[C@@H](OC2=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 C27H32FNO6 MW 485.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32FNO6/c1-18-8-6-13-22(30)12-5-3-4-9-19-14-23(33-2)16-24(26(19)27(32)35-18)34-17-25(31)29-21-11-7-10-20(28)15-21/h7,10-11,14-16,18H,3-6,8-9,12-13,17H2,1-2H3,(H,29,31)/t18-/m0/s1InChIKey
VERWVYCTKWSCIK-SFHVURJKSA-NSynonyms
1212168-01-8(S)N(3fluorophenyl)2((14methoxy3methyl17dioxo3456789101112decahydro1Hbenzo(c)(1)oxacyclotetradecin16yl)oxy)acetamide
~(N)(3fluorophenyl)2(((4~(S))16methoxy4methyl28dioxo3oxabicyclo(1240)octadeca1(14)1517trien18yl)oxy)acetamide
1212168018
16404155
COc1cc(OCC(=O)Nc2cccc(c2)F)c2c(c1)CCCCCC(=O)CCC(C@@H)(OC2=O)C
InChI=1SC27H32FNO6c118861322(30)125349191423(332)1624(26(19)27(32)3518)341725(31)29211171020(28)1521h71011141618H3689121317H212H3(H2931)t18m0s1
MFCD06766289
N(3fluorophenyl)2(((3S)14methoxy3methyl17dioxo3456789101112decahydro1H2benzoxacyclotetradecin16yl)oxy)acetamide
ZINC000012883079
ZINC12883079
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