Vitas-M small molecule compound
5-{[3-(hexadecylcarbamoyl)-4-hydroxynaphthalen-1-yl]oxy}-3-thioxopentanoic acid
Catalog ID
STK379079
SMILES CCCCCCCCCCCCCCCCNC(=O)c1cc(OCCC(=S)CC(=O)O)c2c(c1O)cccc2
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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 C32H47NO5S MW 557.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H47NO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-21-33-32(37)28-24-29(38-22-20-25(39)23-30(34)35)26-18-15-16-19-27(26)31(28)36/h15-16,18-19,24,36H,2-14,17,20-23H2,1H3,(H,33,37)(H,34,35)InChIKey
DPLSPYKZEVEWNW-UHFFFAOYSA-NSynonyms
5((3(hexadecylcarbamoyl)4hydroxynaphthalen1yl)oxy)3thioxopentanoicacid
5(3(HEXADECYLCARBAMOYL)4HYDROXYNAPHTHALEN1YL)OXY3SULFANYLIDENEPENTANOICACID
CCCCCCCCCCCCCCCCNC(=O)C1=C(C2=CC=CC=C2C(=C1)OCCC(=S)CC(=O)O)O
InChI=1SC32H47NO5Sc123456789101112131417213332(37)282429(38222025(39)2330(34)35)261815161927(26)31(28)36h151618192436H214172023H21H3(H3337)(H3435)
MFCD01825519
ZINC000098050360
ZINC98050360
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