Vitas-M small molecule compound
N-[(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-D-alanine
Catalog ID
STL464413
SMILES COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)N[C@@H](C(=O)O)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 C16H16ClNO6 MW 353.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClNO6/c1-7-9-4-11(17)13(23-3)6-12(9)24-16(22)10(7)5-14(19)18-8(2)15(20)21/h4,6,8H,5H2,1-3H3,(H,18,19)(H,20,21)/t8-/m1/s1InChIKey
SSYYWVMBIZIMJJ-MRVPVSSYSA-NSynonyms
(2R)2((2(6CHLORO7METHOXY4METHYL2OXOCHROMEN3YL)ACETYL)AMINO)PROPANOICACID
(S)2(2(6chloro7methoxy4methyl2oxo2Hchromen3yl)acetamido)propanoicacid
CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC)CC(=O)NC(C)C(=O)O
COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)N(C@@H)(C(=O)O)C
COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)N(C@H)(C(=O)O)C
InChI=1SC16H16ClNO6c179411(17)13(233)612(9)2416(22)10(7)514(19)188(2)15(20)21h468H5H213H3(H1819)(H2021)t8m1s1
N((6chloro7methoxy4methyl2oxo2Hchromen3yl)acetyl)Dalanine
ZINC000006075886
ZINC6075886
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