Vitas-M small molecule compound
N-({[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-hydroxy-4-oxo-4H-chromen-7-yl]oxy}acetyl)-L-phenylalanine
Catalog ID
STL564641
SMILES O=C(N[C@H](C(=O)O)Cc1ccccc1)COc1cc(O)c2c(c1)occ(c2=O)c1ccc2c(c1)OCCO2
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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 C28H23NO9 MW 517.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23NO9/c30-21-12-18(37-15-25(31)29-20(28(33)34)10-16-4-2-1-3-5-16)13-24-26(21)27(32)19(14-38-24)17-6-7-22-23(11-17)36-9-8-35-22/h1-7,11-14,20,30H,8-10,15H2,(H,29,31)(H,33,34)/t20-/m0/s1InChIKey
UGSACCBMCOUBIJ-FQEVSTJZSA-NSynonyms
(2S)2((2(3(23dihydro14benzodioxin6yl)5hydroxy4oxochromen7yl)oxyacetyl)amino)3phenylpropanoicacid
(R)2(2((3(23dihydrobenzo(b)(14)dioxin6yl)5hydroxy4oxo4Hchromen7yl)oxy)acetamido)3phenylpropanoicacid
6351606
InChI=1SC28H23NO9c30211218(371525(31)2920(28(33)34)10164213516)132426(21)27(32)19(143824)17672223(1117)36983522h1711142030H81015H2(H2931)(H3334)t20m0s1
MFCD32651524
N(((3(23dihydro14benzodioxin6yl)5hydroxy4oxo4Hchromen7yl)oxy)acetyl)Lphenylalanine
O=C(N(C@@H)(C(=O)O)Cc1ccccc1)COc1cc(O)c2c(c1)occ(c2=O)c1ccc2c(c1)OCCO2
ZINC000002106564
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