Vitas-M small molecule compound
N-{[(3-hexyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-L-alanine
Catalog ID
STL460799
SMILES CCCCCCc1c(=O)oc2c(c1C)ccc(c2)OCC(=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 C21H27NO6 MW 389.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27NO6/c1-4-5-6-7-8-17-13(2)16-10-9-15(11-18(16)28-21(17)26)27-12-19(23)22-14(3)20(24)25/h9-11,14H,4-8,12H2,1-3H3,(H,22,23)(H,24,25)/t14-/m0/s1InChIKey
SSNNGMRBCCUBQG-AWEZNQCLSA-NSynonyms
956046-05-2(2S)2((2(3HEXYL4METHYL2OXOCHROMEN7YL)OXYACETYL)AMINO)PROPANOICACID
(S)2(2((3hexyl4methyl2oxo2Hchromen7yl)oxy)acetamido)propanoicacid
956046052
CCCCCCC1=C(C2=C(C=C(C=C2)OCC(=O)NC(C)C(=O)O)OC1=O)C
CCCCCCc1c(=O)oc2c(c1C)ccc(c2)OCC(=O)N(C@H)(C(=O)O)C
InChI=1SC21H27NO6c1456781713(2)1610915(1118(16)2821(17)26)271219(23)2214(3)20(24)25h91114H4812H213H3(H2223)(H2425)t14m0s1
N(((3hexyl4methyl2oxo2Hchromen7yl)oxy)acetyl)Lalanine
ZINC000002129628
ZINC2129628
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