Vitas-M small molecule compound
6-chloro-3,4-dimethyl-2-oxo-2H-chromen-7-yl N-[(benzyloxy)carbonyl]-L-isoleucinate
Catalog ID
STK594187
SMILES CC[C@H]([C@@H](C(=O)Oc1cc2oc(=O)c(c(c2cc1Cl)C)C)NC(=O)OCc1ccccc1)C
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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 C25H26ClNO6 MW 471.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClNO6/c1-5-14(2)22(27-25(30)31-13-17-9-7-6-8-10-17)24(29)33-21-12-20-18(11-19(21)26)15(3)16(4)23(28)32-20/h6-12,14,22H,5,13H2,1-4H3,(H,27,30)/t14-,22+/m1/s1InChIKey
LKFIIXBFSIJOEG-PEBXRYMYSA-NSynonyms
1014022-15-1(2S3R)6chloro34dimethyl2oxo2Hchromen7yl2(((benzyloxy)carbonyl)amino)3methylpentanoate
(6chloro34dimethyl2oxochromen7yl)(2S3R)3methyl2(phenylmethoxycarbonylamino)pentanoate
1014022151
6chloro34dimethyl2oxo2Hchromen7ylN((benzyloxy)carbonyl)Lisoleucinate
CC(C@H)((C@@H)(C(=O)Oc1cc2oc(=O)c(c(c2cc1Cl)C)C)NC(=O)OCc1ccccc1)C
CCC(C)C(C(=O)OC1=C(C=C2C(=C(C(=O)OC2=C1)C)C)Cl)NC(=O)OCC3=CC=CC=C3
InChI=1SC25H26ClNO6c1514(2)22(2725(30)31131797681017)24(29)3321122018(1119(21)26)15(3)16(4)23(28)3220h6121422H513H214H3(H2730)t1422+m1s1
MFCD18245982
ZINC000009448985
ZINC09448985
ZINC9448985
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