Vitas-M small molecule compound
3-[(1S,2S,5R)-4-oxo-6,8-dioxabicyclo[3.2.1]oct-2-yl]-1,3-benzoxazol-2(3H)-one (non-preferred name)
Catalog ID
STK769209
SMILES O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1c(=O)oc2c1cccc2
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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 C13H11NO5 MW 261.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11NO5/c15-9-5-8(11-6-17-12(9)18-11)14-7-3-1-2-4-10(7)19-13(14)16/h1-4,8,11-12H,5-6H2/t8-,11+,12+/m0/s1InChIKey
SDNPWXVGSFCVMZ-XXILOJSOSA-NSynonyms
3((1S2S5R)4oxo68dioxabicyclo(321)oct2yl)13benzoxazol2(3H)one(nonpreferredname)
3((1S2S5R)4OXO68DIOXABICYCLO(321)OCTAN2YL)13BENZOXAZOL2ONE
C1C(C2COC(C1=O)O2)N3C4=CC=CC=C4OC3=O
InChI=1SC13H11NO5c15958(1161712(9)1811)147312410(7)1913(14)16h1481112H56H2t811+12+m0s1
MFCD13372151
O=C1C(C@@H)((C@@H)2O(C@H)1OC2)n1c(=O)oc2c1cccc2
ZINC000001050184
ZINC01050184
ZINC1050184
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