Vitas-M small molecule compound
N-[3-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoyl]-L-alanine
Catalog ID
STL548949
SMILES O=C(N[C@H](C(=O)O)C)CCc1c(=O)oc2c(c1C)cc(c(c2)O)Cl
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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 C16H16ClNO6 MW 353.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClNO6/c1-7-9(3-4-14(20)18-8(2)15(21)22)16(23)24-13-6-12(19)11(17)5-10(7)13/h5-6,8,19H,3-4H2,1-2H3,(H,18,20)(H,21,22)/t8-/m0/s1InChIKey
FCYSSYDOGGGXSW-QMMMGPOBSA-NSynonyms
1008697-35-5(S)2(3(6chloro7hydroxy4methyl2oxo2Hchromen3yl)propanamido)propanoicacid
1008697355
InChI=1SC16H16ClNO6c179(3414(20)188(2)15(21)22)16(23)2413612(19)11(17)510(7)13h56819H34H212H3(H1820)(H2122)t8m0s1
N(3(6chloro7hydroxy4methyl2oxo2Hchromen3yl)propanoyl)Lalanine
O=C(N(C@H)(C(=O)O)C)CCc1c(=O)oc2c(c1C)cc(c(c2)O)Cl
ZINC000002108678
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