Vitas-M small molecule compound
methyl 4-{[7-({N-[(benzyloxy)carbonyl]-beta-alanyl}oxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-3-yl]oxy}benzoate
Catalog ID
STK624663
SMILES COC(=O)c1ccc(cc1)Oc1c(=O)c2ccc(cc2oc1C(F)(F)F)OC(=O)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 C29H22F3NO9 MW 585.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22F3NO9/c1-38-27(36)18-7-9-19(10-8-18)41-25-24(35)21-12-11-20(15-22(21)42-26(25)29(30,31)32)40-23(34)13-14-33-28(37)39-16-17-5-3-2-4-6-17/h2-12,15H,13-14,16H2,1H3,(H,33,37)InChIKey
UNBJWICYYYYLRP-UHFFFAOYSA-NSynonyms
305866-31-3305866313
COC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)CCNC(=O)OCC4=CC=CC=C4)C(F)(F)F
InChI=1SC29H22F3NO9c13827(36)187919(10818)412524(35)21121120(1522(21)4226(25)29(3031)32)4023(34)13143328(37)3916175324617h21215H131416H21H3(H3337)
methyl4((7((3(((benzyloxy)carbonyl)amino)propanoyl)oxy)4oxo2(trifluoromethyl)4Hchromen3yl)oxy)benzoate
methyl4((7((N((benzyloxy)carbonyl)betaalanyl)oxy)4oxo2(trifluoromethyl)4Hchromen3yl)oxy)benzoate
METHYL4(4OXO7(3(PHENYLMETHOXYCARBONYLAMINO)PROPANOYLOXY)2(TRIFLUOROMETHYL)CHROMEN3YL)OXYBENZOATE
MFCD00595803
ZINC000101266273
ZINC101266273
Check stock
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