Vitas-M small molecule compound
methyl 4-[(Z)-{9-[3-(2-amino-2-oxoethoxy)phenyl]-3,7-dioxo-8,9-dihydro-7H-furo[2,3-f]chromen-2(3H)-ylidene}methyl]benzoate
Catalog ID
STL546385
SMILES COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc1c2C(CC(=O)O1)c1cccc(c1)OCC(=O)N
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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 C28H21NO8 MW 499.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21NO8/c1-34-28(33)16-7-5-15(6-8-16)11-22-26(32)19-9-10-21-25(27(19)37-22)20(13-24(31)36-21)17-3-2-4-18(12-17)35-14-23(29)30/h2-12,20H,13-14H2,1H3,(H2,29,30)/b22-11-InChIKey
HVHFMHDZEZGVOE-JJFYIABZSA-NSynonyms
(Z)methyl4((9(3(2amino2oxoethoxy)phenyl)37dioxo3789tetrahydro2Hfuro(23f)chromen2ylidene)methyl)benzoate
121541883
COC(=O)c1ccc(cc1)C=C1Oc2c(C1=O)ccc1c2C(CC(=O)O1)c1cccc(c1)OCC(=O)N
InChI=1SC28H21NO8c13428(33)167515(6816)112226(32)199102125(27(19)3722)20(1324(31)3621)1732418(1217)351423(29)30h21220H1314H21H3(H22930)b2211
methyl4((~(Z))(9(3(2amino2oxoethoxy)phenyl)37dioxo89dihydrofuro(23f)chromen2ylidene)methyl)benzoate
methyl4((Z)(9(3(2amino2oxoethoxy)phenyl)37dioxo89dihydro7Hfuro(23f)chromen2(3H)ylidene)methyl)benzoate
MFCD30344424
ZINC000263585366
ZINC001081801512
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