Vitas-M small molecule compound
ethyl 2-amino-4-[4-(benzyloxy)phenyl]-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STK827882
SMILES CCOC(=O)C1=C(N)OC2=C(C1c1ccc(cc1)OCc1ccccc1)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 C27H29NO5 MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO5/c1-4-31-26(30)24-22(23-20(29)14-27(2,3)15-21(23)33-25(24)28)18-10-12-19(13-11-18)32-16-17-8-6-5-7-9-17/h5-13,22H,4,14-16,28H2,1-3H3InChIKey
GAXMTOSNOUPDAM-UHFFFAOYSA-NSynonyms
329934-99-8329934998
CCOC(=O)C1=C(OC2=C(C1C3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)CC(C2)(C)C)N
ethyl2amino4(4(benzyloxy)phenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carboxylate
ETHYL2AMINO77DIMETHYL5OXO4(4(PHENYLMETHOXY)PHENYL)4H678TRIHYDROCHROMENE3CARBOXYLATE
ETHYL2AMINO77DIMETHYL5OXO4(4PHENYLMETHOXYPHENYL)68DIHYDRO4HCHROMENE3CARBOXYLATE
InChI=1SC27H29NO5c143126(30)2422(2320(29)1427(23)1521(23)3325(24)28)18101219(131118)3216178657917h51322H4141628H213H3
MFCD00854777
ZINC000001104386
ZINC000001104387
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