Vitas-M small molecule compound
4-chloro-N-{[(4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]acetyl}phenylalanine
Catalog ID
STL463935
SMILES O=C(NC(C(=O)O)Cc1ccc(cc1)Cl)COc1cc2OC(C)(C)CCc2c2c1c(C)cc(=O)o2
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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 C26H26ClNO7 MW 499.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClNO7/c1-14-10-22(30)34-24-17-8-9-26(2,3)35-19(17)12-20(23(14)24)33-13-21(29)28-18(25(31)32)11-15-4-6-16(27)7-5-15/h4-7,10,12,18H,8-9,11,13H2,1-3H3,(H,28,29)(H,31,32)InChIKey
UTJDAYALMCIMIH-UHFFFAOYSA-NSynonyms
888027-41-63(4chlorophenyl)2((2((488trimethyl2oxo910dihydropyrano(23h)chromen5yl)oxy)acetyl)amino)propanoicacid
3(4chlorophenyl)2(2((488trimethyl2oxo28910tetrahydropyrano(23f)chromen5yl)oxy)acetamido)propanoicacid
4chloroN(((488trimethyl2oxo910dihydro2H8Hpyrano(23f)chromen5yl)oxy)acetyl)phenylalanine
888027416
CC1=CC(=O)OC2=C3CCC(OC3=CC(=C12)OCC(=O)NC(CC4=CC=C(C=C4)Cl)C(=O)O)(C)C
InChI=1SC26H26ClNO7c1141022(30)3424178926(23)3519(17)1220(23(14)24)331321(29)2818(25(31)32)11154616(27)7515h47101218H891113H213H3(H2829)(H3132)
MFCD07637197
ZINC000008876208
ZINC000008876209
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