Vitas-M small molecule compound
(3aR,4R,4aR,7aS,8R,8aR)-6-cyclohexyl-3-(3,4-dimethoxyphenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Catalog ID
STK580804
SMILES COc1cc(ccc1OC)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=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 C24H28N2O5 MW 424.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O5/c1-29-16-9-8-12(10-17(16)30-2)21-20-14-11-15(22(20)31-25-21)19-18(14)23(27)26(24(19)28)13-6-4-3-5-7-13/h8-10,13-15,18-20,22H,3-7,11H2,1-2H3/t14-,15+,18+,19-,20+,22+/m0/s1InChIKey
BMXXWZXOTWJMAA-KXYKCTRLSA-NSynonyms
1014001-62-7(3aR4R4aR7aS8R8aR)6cyclohexyl3(34dimethoxyphenyl)44a88atetrahydro3aH48methanoisoxazolo(45f)isoindole57(6H7aH)dione
(3aR4R4aR7aS8R8aR)6cyclohexyl3(34dimethoxyphenyl)4a7a88atetrahydro3aH48methano(12)oxazolo(45f)isoindole57(4H6H)dione
1014001627
COc1cc(ccc1OC)C1=NO(C@H)2(C@@H)1(C@@H)1C(C@H)2(C@H)2(C@@H)1C(=O)N(C2=O)C1CCCCC1
COc1cc(ccc1OC)C1=NO(C@H)2(C@@H)1(C@H)1C(C@@H)2(C@H)2(C@@H)1C(=O)N(C2=O)C1CCCCC1
MFCD18245657
ZINC000009450659
Check stock
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Check stock on Vitas-MAvailable files
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