Vitas-M small molecule compound
(3aR,4R,4aR,7aS,8R,8aR)-3-(2,3-dimethoxyphenyl)-6-[2-(dimethylamino)ethyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Catalog ID
STK601197
SMILES COc1c(OC)cccc1C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)CCN(C)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 C22H27N3O5 MW 413.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O5/c1-24(2)8-9-25-21(26)15-12-10-13(16(15)22(25)27)20-17(12)18(23-30-20)11-6-5-7-14(28-3)19(11)29-4/h5-7,12-13,15-17,20H,8-10H2,1-4H3/t12-,13+,15+,16-,17+,20+/m0/s1InChIKey
PDGGZHFADDVANG-DLJSNBOKSA-NSynonyms
1212314-48-1(3aR4R4aR7aS8R8aR)3(23dimethoxyphenyl)6(2(dimethylamino)ethyl)44a88atetrahydro3aH48methanoisoxazolo(45f)isoindole57(6H7aH)dione
(3aR4R4aR7aS8R8aR)3(23dimethoxyphenyl)6(2(dimethylamino)ethyl)4a7a88atetrahydro3aH48methano(12)oxazolo(45f)isoindole57(4H6H)dione
1212314481
CN(C)CCN1C(=O)C2C3CC(C2C1=O)C4C3C(=NO4)C5=C(C(=CC=C5)OC)OC
COc1c(OC)cccc1C1=NO(C@H)2(C@@H)1(C@@H)1C(C@H)2(C@H)2(C@@H)1C(=O)N(C2=O)CCN(C)C
COc1c(OC)cccc1C1=NO(C@H)2(C@@H)1(C@H)1C(C@@H)2(C@H)2(C@@H)1C(=O)N(C2=O)CCN(C)C
InChI=1SC22H27N3O5c124(2)892521(26)15121013(16(15)22(25)27)2017(12)18(233020)1165714(283)19(11)294h571213151720H810H214H3t1213+1516+1720m1s1
MFCD18246145
ZINC000005488411
Check stock
See real-time availability and sample size for STK601197 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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