Vitas-M small molecule compound
3-(4-chlorophenoxy)-2-methyl-4-oxo-4H-chromen-7-yl N-[(benzyloxy)carbonyl]valinate
Catalog ID
STL525217
SMILES O=C(NC(C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccc(cc1)Cl)C)C(C)C)OCc1ccccc1
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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 C29H26ClNO7 MW 535.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26ClNO7/c1-17(2)25(31-29(34)35-16-19-7-5-4-6-8-19)28(33)38-22-13-14-23-24(15-22)36-18(3)27(26(23)32)37-21-11-9-20(30)10-12-21/h4-15,17,25H,16H2,1-3H3,(H,31,34)InChIKey
QNVMCWCMGQHKIU-UHFFFAOYSA-NSynonyms
(3(4CHLOROPHENOXY)2METHYL4OXOCHROMEN7YL)3METHYL2(PHENYLMETHOXYCARBONYLAMINO)BUTANOATE
(S)3(4chlorophenoxy)2methyl4oxo4Hchromen7yl2(((benzyloxy)carbonyl)amino)3methylbutanoate
3(4chlorophenoxy)2methyl4oxo4Hchromen7ylN((benzyloxy)carbonyl)valinate
3712077
InChI=1SC29H26ClNO7c117(2)25(3129(34)3516197546819)28(33)382213142324(1522)3618(3)27(26(23)32)372111920(30)101221h4151725H16H213H3(H3134)
MFCD00571758
O=C(N(C@H)(C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccc(cc1)Cl)C)C(C)C)OCc1ccccc1
ZINC000002090389
ZINC000002090391
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