Vitas-M small molecule compound
3-chloro-4-methyl-2-oxo-2H-chromen-7-yl N-[(benzyloxy)carbonyl]-L-valinate
Catalog ID
STK717837
SMILES O=C(N[C@H](C(=O)Oc1ccc2c(c1)oc(=O)c(c2C)Cl)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 C23H22ClNO6 MW 443.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClNO6/c1-13(2)20(25-23(28)29-12-15-7-5-4-6-8-15)22(27)30-16-9-10-17-14(3)19(24)21(26)31-18(17)11-16/h4-11,13,20H,12H2,1-3H3,(H,25,28)/t20-/m0/s1InChIKey
LLJRITVCYCZUAD-FQEVSTJZSA-NSynonyms
(3CHLORO4METHYL2OXOCHROMEN7YL)(2S)3METHYL2(PHENYLMETHOXYCARBONYLAMINO)BUTANOATE
3chloro4methyl2oxo2Hchromen7yl2(((benzyloxy)carbonyl)amino)3methylbutanoate
3chloro4methyl2oxo2Hchromen7ylN((benzyloxy)carbonyl)Lvalinate
CC1=C(C(=O)OC2=C1C=CC(=C2)OC(=O)C(C(C)C)NC(=O)OCC3=CC=CC=C3)Cl
InChI=1SC23H22ClNO6c113(2)20(2523(28)2912157546815)22(27)30169101714(3)19(24)21(26)3118(17)1116h4111320H12H213H3(H2528)t20m0s1
MFCD13371590
O=C(N(C@H)(C(=O)Oc1ccc2c(c1)oc(=O)c(c2C)Cl)C(C)C)OCc1ccccc1
O=C(NC(C(=O)Oc1ccc2c(c1)oc(=O)c(c2C)Cl)C(C)C)OCc1ccccc1
ZINC000000627691
ZINC00627691
ZINC627691
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