Vitas-M small molecule compound
[(5S)-5-(cyclohexylcarbamoyl)-3-(4-nitrophenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetic acid
Catalog ID
STK585789
SMILES O=C([C@@]1(ON=C(C1)c1ccc(cc1)[N+](=O)[O-])CC(=O)O)NC1CCCCC1
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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 C18H21N3O6 MW 375.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O6/c22-16(23)11-18(17(24)19-13-4-2-1-3-5-13)10-15(20-27-18)12-6-8-14(9-7-12)21(25)26/h6-9,13H,1-5,10-11H2,(H,19,24)(H,22,23)/t18-/m0/s1InChIKey
XUBHKIZSBCJTGV-SFHVURJKSA-NSynonyms
1212103-71-3((5S)5(cyclohexylcarbamoyl)3(4nitrophenyl)45dihydro12oxazol5yl)aceticacid
(S)2(5(cyclohexylcarbamoyl)3(4nitrophenyl)45dihydroisoxazol5yl)aceticacid
1212103713
2((5S)5(CYCLOHEXYLCARBAMOYL)3(4NITROPHENYL)4H12OXAZOL5YL)ACETICACID
C1CCC(CC1)NC(=O)C2(CC(=NO2)C3=CC=C(C=C3)(N+)(=O)(O))CC(=O)O
InChI=1SC18H21N3O6c2216(23)1118(17(24)19134213513)1015(202718)126814(9712)21(25)26h6913H151011H2(H1924)(H2223)t18m0s1
MFCD08284581
O=C((C@@)1(ON=C(C1)c1ccc(cc1)(N+)(=O)(O))CC(=O)O)NC1CCCCC1
ZINC000005451652
ZINC5451652
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