Vitas-M small molecule compound
N-{[3-(4-bromophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}-D-valine
Catalog ID
STL464057
SMILES O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Br)N[C@@H](C(=O)O)C(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 C25H22BrNO6 MW 512.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrNO6/c1-12(2)23(24(29)30)27-22(28)9-17-13(3)16-8-18-19(14-4-6-15(26)7-5-14)11-32-20(18)10-21(16)33-25(17)31/h4-8,10-12,23H,9H2,1-3H3,(H,27,28)(H,29,30)/t23-/m1/s1InChIKey
FMIUJODOVFEPII-HSZRJFAPSA-NSynonyms
(2R)2((2(3(4bromophenyl)5methyl7oxofuro(32g)chromen6yl)acetyl)amino)3methylbutanoicacid
(S)2(2(3(4bromophenyl)5methyl7oxo7Hfuro(32g)chromen6yl)acetamido)3methylbutanoicacid
CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C4=CC=C(C=C4)Br)CC(=O)NC(C(C)C)C(=O)O
InChI=1SC25H22BrNO6c112(2)23(24(29)30)2722(28)91713(3)1681819(144615(26)7514)113220(18)1021(16)3325(17)31h48101223H9H213H3(H2728)(H2930)t23m1s1
MFCD06495084
N((3(4bromophenyl)5methyl7oxo7Hfuro(32g)chromen6yl)acetyl)Dvaline
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Br)N(C@@H)(C(=O)O)C(C)C
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Br)N(C@H)(C(=O)O)C(C)C
ZINC000011865567
ZINC11865567
Check stock
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Check stock on Vitas-MAvailable files
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