Vitas-M small molecule compound
N-{[3-(4-chlorophenyl)-5,9-dimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}-L-isoleucine
Catalog ID
STL529789
SMILES CC[C@H]([C@@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)Cl)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 C27H26ClNO6 MW 495.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClNO6/c1-5-13(2)23(26(31)32)29-22(30)11-19-14(3)18-10-20-21(16-6-8-17(28)9-7-16)12-34-24(20)15(4)25(18)35-27(19)33/h6-10,12-13,23H,5,11H2,1-4H3,(H,29,30)(H,31,32)/t13-,23+/m1/s1InChIKey
SBXNUUFQPCEKRU-ZLOXQWCVSA-NSynonyms
956683-96-8(2~(S)3~(R))2((2(3(4chlorophenyl)59dimethyl7oxofuro(32g)chromen6yl)acetyl)amino)3methylpentanoicacid
(2S3R)2((2(3(4CHLOROPHENYL)59DIMETHYL7OXOFURO(32G)CHROMEN6YL)ACETYL)AMINO)3METHYLPENTANOICACID
(2S3R)2(2(3(4chlorophenyl)59dimethyl7oxo7Hfuro(32g)chromen6yl)acetamido)3methylpentanoicacid
1772477
956683968
CC(C@H)((C@@H)(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)Cl)C
InChI=1SC27H26ClNO6c1513(2)23(26(31)32)2922(30)111914(3)18102021(166817(28)9716)123424(20)15(4)25(18)3527(19)33h610121323H511H214H3(H2930)(H3132)t1323+m1s1
MFCD05674051
N((3(4chlorophenyl)59dimethyl7oxo7Hfuro(32g)chromen6yl)acetyl)Lisoleucine
ZINC000002117886
ZINC2117886
Check stock
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Check stock on Vitas-MAvailable files
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