Vitas-M small molecule compound
3-(4-fluorophenyl)-4-oxo-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate
Catalog ID
STL298389
SMILES O=C(Oc1ccc2c(c1)occ(c2=O)c1ccc(cc1)F)CCNC(=O)OCc1ccccc1
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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 C26H20FNO6 MW 461.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20FNO6/c27-19-8-6-18(7-9-19)22-16-32-23-14-20(10-11-21(23)25(22)30)34-24(29)12-13-28-26(31)33-15-17-4-2-1-3-5-17/h1-11,14,16H,12-13,15H2,(H,28,31)InChIKey
RABTVESTSYWUPD-UHFFFAOYSA-NSynonyms
329709-48-0(3(4FLUOROPHENYL)4OXOCHROMEN7YL)3(PHENYLMETHOXYCARBONYLAMINO)PROPANOATE
3(4fluorophenyl)4oxo4Hchromen7yl3(((benzyloxy)carbonyl)amino)propanoate
3(4fluorophenyl)4oxo4Hchromen7ylN((benzyloxy)carbonyl)betaalaninate
329709480
C1=CC=C(C=C1)COC(=O)NCCC(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=C(C=C4)F
InChI=1SC26H20FNO6c27198618(7919)221632231420(101121(23)25(22)30)3424(29)12132826(31)3315174213517h1111416H121315H2(H2831)
MFCD01563270
ZINC000002998265
ZINC02998265
ZINC2998265
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