Vitas-M small molecule compound
(3aR,4R,4aR,7aS,8R,8aR)-3-(4-chlorophenyl)-6-[2-(3,4-dimethoxyphenyl)ethyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Catalog ID
STK574613
SMILES COc1ccc(cc1OC)CCN1C(=O)[C@@H]2[C@H](C1=O)[C@H]1C[C@@H]2[C@@H]2[C@H]1C(=NO2)c1ccc(cc1)Cl
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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 C26H25ClN2O5 MW 480.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2O5/c1-32-18-8-3-13(11-19(18)33-2)9-10-29-25(30)20-16-12-17(21(20)26(29)31)24-22(16)23(28-34-24)14-4-6-15(27)7-5-14/h3-8,11,16-17,20-22,24H,9-10,12H2,1-2H3/t16-,17+,20+,21-,22+,24+/m0/s1InChIKey
UITNRGVVMUITBU-CPIFZSQSSA-NSynonyms
1014021-19-2(3aR4R4aR7aS8R8aR)3(4chlorophenyl)6(2(34dimethoxyphenyl)ethyl)4a7a88atetrahydro3aH48methano(12)oxazolo(45f)isoindole57(4H6H)dione
(3aR4R4aR7aS8R8aR)3(4chlorophenyl)6(34dimethoxyphenethyl)44a88atetrahydro3aH48methanoisoxazolo(45f)isoindole57(6H7aH)dione
1014021192
COc1ccc(cc1OC)CCN1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)1C(C@H)2(C@@H)2(C@H)1C(=NO2)c1ccc(cc1)Cl
COc1ccc(cc1OC)CCN1C(=O)(C@@H)2(C@H)(C1=O)(C@H)1C(C@@H)2(C@@H)2(C@H)1C(=NO2)c1ccc(cc1)Cl
MFCD18245509
ZINC000009187307
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