Vitas-M small molecule compound
3-(4-chlorophenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl N-[(benzyloxy)carbonyl]-D-valinate
Catalog ID
STK063046
SMILES O=C(N[C@@H](C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccc(cc1)Cl)C(F)(F)F)C(C)C)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 C29H23ClF3NO7 MW 589.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23ClF3NO7/c1-16(2)23(34-28(37)38-15-17-6-4-3-5-7-17)27(36)40-20-12-13-21-22(14-20)41-26(29(31,32)33)25(24(21)35)39-19-10-8-18(30)9-11-19/h3-14,16,23H,15H2,1-2H3,(H,34,37)/t23-/m1/s1InChIKey
PHGICBPDUXQMTL-HSZRJFAPSA-NSynonyms
(3(4CHLOROPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YL)(2R)3METHYL2(PHENYLMETHOXYCARBONYLAMINO)BUTANOATE
(R)3(4chlorophenoxy)4oxo2(trifluoromethyl)4Hchromen7yl2(((benzyloxy)carbonyl)amino)3methylbutanoate
3(4CHLOROPHENOXY)4OXO2(TRIFLUOROMETHYL)4HCHROMEN7YLN((BENZYLOXY)CARBONYL)DVALINATE
CC(C)C(C(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=C(C=C3)Cl)NC(=O)OCC4=CC=CC=C4
InChI=1SC29H23ClF3NO7c116(2)23(3428(37)3815176435717)27(36)402012132122(1420)4126(29(3132)33)25(24(21)35)391910818(30)91119h3141623H15H212H3(H3437)t23m1s1
MFCD13368360
O=C(N(C@@H)(C(=O)Oc1ccc2c(c1)oc(c(c2=O)Oc1ccc(cc1)Cl)C(F)(F)F)C(C)C)OCc1ccccc1
STK063046
ZINC000001737315
ZINC01737315
ZINC1737315
Check stock
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