Vitas-M small molecule compound
(1S,2S,4S,6R)-3-[(4-methylphenyl)carbonyl]-7,9-dioxatricyclo[4.2.1.0~2,4~]nonan-5-one
Catalog ID
STK785310
SMILES O=C1[C@@H]2OC[C@@H](O2)[C@@H]2[C@H]1C2C(=O)c1ccc(cc1)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 C15H14O4 MW 258.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14O4/c1-7-2-4-8(5-3-7)13(16)11-10-9-6-18-15(19-9)14(17)12(10)11/h2-5,9-12,15H,6H2,1H3/t9-,10+,11?,12+,15-/m1/s1InChIKey
IWMIXZGEYZWXFT-ZMBSVCMPSA-NSynonyms
(1S2S4S6R)3((4methylphenyl)carbonyl)79dioxatricyclo(4210~24~)nonan5one
CC1=CC=C(C=C1)C(=O)C2C3C2C(=O)C4OCC3O4
InChI=1SC15H14O4c17248(537)13(16)1110961815(199)14(17)12(10)11h2591215H6H21H3t910+11?12+15m1s1
MFCD08142169
O=C1(C@@H)2OC(C@@H)(O2)(C@@H)2(C@H)1C2C(=O)c1ccc(cc1)C
ZINC000004779389
ZINC000032165723
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