Vitas-M small molecule compound
(1S,2S,4S,6R)-3-(phenylcarbonyl)-7,9-dioxatricyclo[4.2.1.0~2,4~]nonan-5-one
Catalog ID
STK673048
SMILES O=C1[C@@H]2OC[C@@H](O2)[C@@H]2[C@H]1C2C(=O)c1ccccc1
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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 C14H12O4 MW 244.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12O4/c15-12(7-4-2-1-3-5-7)10-9-8-6-17-14(18-8)13(16)11(9)10/h1-5,8-11,14H,6H2/t8-,9+,10?,11+,14-/m1/s1InChIKey
CZIBSUDQYDYHIT-GOALFRKDSA-NSynonyms
(1S2S4S6R)3(phenylcarbonyl)79dioxatricyclo(4210~24~)nonan5one
C1C2C3C(C3C(=O)C4=CC=CC=C4)C(=O)C(O1)O2
InChI=1SC14H12O4c1512(7421357)109861714(188)13(16)11(9)10h1581114H6H2t89+10?11+14m1s1
MFCD18246851
O=C1(C@@H)2OC(C@@H)(O2)(C@@H)2(C@H)1C2C(=O)c1ccccc1
ZINC000006646118
ZINC000015162427
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