Vitas-M small molecule compound
ethyl 2-amino-4-{4-methoxy-3-[(4-methylphenoxy)methyl]phenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STL174071
SMILES CCOC(=O)C1=C(N)OC2=C(C1c1ccc(c(c1)COc1ccc(cc1)C)OC)C(=O)CC(C2)(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 C29H33NO6 MW 491.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33NO6/c1-6-34-28(32)26-24(25-21(31)14-29(3,4)15-23(25)36-27(26)30)18-9-12-22(33-5)19(13-18)16-35-20-10-7-17(2)8-11-20/h7-13,24H,6,14-16,30H2,1-5H3InChIKey
JKHOBYTUHGGBCE-UHFFFAOYSA-NSynonyms
445037-42-3445037423
CCOC(=O)C1=C(OC2=C(C1C3=CC(=C(C=C3)OC)COC4=CC=C(C=C4)C)C(=O)CC(C2)(C)C)N
ethyl2amino4(4methoxy3((4methylphenoxy)methyl)phenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carboxylate
ETHYL2AMINO4(4METHOXY3((4METHYLPHENOXY)METHYL)PHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBOXYLATE
InChI=1SC29H33NO6c163428(32)2624(2521(31)1429(34)1523(25)3627(26)30)1891222(335)19(1318)16352010717(2)81120h71324H6141630H215H3
MFCD02373444
ZINC000000648999
ZINC000000649000
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