Vitas-M small molecule compound
(1S,2S,4S,6R)-3-[(4-fluorophenyl)carbonyl]-7,9-dioxatricyclo[4.2.1.0~2,4~]nonan-5-one
Catalog ID
STK785308
SMILES O=C1[C@@H]2OC[C@@H](O2)[C@@H]2[C@H]1C2C(=O)c1ccc(cc1)F
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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 C14H11FO4 MW 262.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11FO4/c15-7-3-1-6(2-4-7)12(16)10-9-8-5-18-14(19-8)13(17)11(9)10/h1-4,8-11,14H,5H2/t8-,9+,10?,11+,14-/m1/s1InChIKey
XLWJCKJOMYVUEB-GOALFRKDSA-NSynonyms
(1S2S4S6R)3((4fluorophenyl)carbonyl)79dioxatricyclo(4210~24~)nonan5one
C1C2C3C(C3C(=O)C4=CC=C(C=C4)F)C(=O)C(O1)O2
InChI=1SC14H11FO4c157316(247)12(16)109851814(198)13(17)11(9)10h1481114H5H2t89+10?11+14m1s1
MFCD08142167
O=C1(C@@H)2OC(C@@H)(O2)(C@@H)2(C@H)1C2C(=O)c1ccc(cc1)F
ZINC000004779385
ZINC000032165718
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