Vitas-M small molecule compound
(3aR,4R,4aR,7aS,8R,8aR)-3-(2,3-dimethoxyphenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Catalog ID
STK597751
SMILES COc1c(OC)cccc1C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)NC2=O
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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 C18H18N2O5 MW 342.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O5/c1-23-10-5-3-4-7(15(10)24-2)14-13-8-6-9(16(13)25-20-14)12-11(8)17(21)19-18(12)22/h3-5,8-9,11-13,16H,6H2,1-2H3,(H,19,21,22)/t8-,9+,11+,12-,13+,16+/m0/s1InChIKey
JZBUIRWQQGHKOS-CBGBLGFFSA-NSynonyms
1212158-82-1(3aR4R4aR7aS8R8aR)3(23dimethoxyphenyl)44a88atetrahydro3aH48methanoisoxazolo(45f)isoindole57(6H7aH)dione
(3aR4R4aR7aS8R8aR)3(23dimethoxyphenyl)4a7a88atetrahydro3aH48methano(12)oxazolo(45f)isoindole57(4H6H)dione
1212158821
COC1=CC=CC(=C1OC)C2=NOC3C2C4CC3C5C4C(=O)NC5=O
COc1c(OC)cccc1C1=NO(C@H)2(C@@H)1(C@@H)1C(C@H)2(C@H)2(C@@H)1C(=O)NC2=O
COc1c(OC)cccc1C1=NO(C@H)2(C@@H)1(C@H)1C(C@@H)2(C@H)2(C@@H)1C(=O)NC2=O
InChI=1SC18H18N2O5c123105347(15(10)242)1413869(16(13)252014)1211(8)17(21)1918(12)22h3589111316H6H212H3(H192122)t89+1112+1316m1s1
MFCD18246070
ZINC000005451629
Check stock
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Check stock on Vitas-MAvailable files
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