Vitas-M small molecule compound
6-(2,3-dibromopropyl)-4,8-dimethyl-2-oxo-2H-chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate
Catalog ID
STK717849
SMILES BrCC(Cc1cc2c(C)cc(=O)oc2c(c1OC(=O)CCNC(=O)OCc1ccccc1)C)Br
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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 C25H25Br2NO6 MW 595.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25Br2NO6/c1-15-10-22(30)34-24-16(2)23(18(12-20(15)24)11-19(27)13-26)33-21(29)8-9-28-25(31)32-14-17-6-4-3-5-7-17/h3-7,10,12,19H,8-9,11,13-14H2,1-2H3,(H,28,31)InChIKey
NQATYEOVTLLZER-UHFFFAOYSA-NSynonyms
(6(23DIBROMOPROPYL)48DIMETHYL2OXOCHROMEN7YL)3(PHENYLMETHOXYCARBONYLAMINO)PROPANOATE
6(23dibromopropyl)48dimethyl2oxo2Hchromen7yl3(((benzyloxy)carbonyl)amino)propanoate
6(23dibromopropyl)48dimethyl2oxo2Hchromen7ylN((benzyloxy)carbonyl)betaalaninate
CC1=CC(=O)OC2=C(C(=C(C=C12)CC(CBr)Br)OC(=O)CCNC(=O)OCC3=CC=CC=C3)C
InChI=1SC25H25Br2NO6c1151022(30)342416(2)23(18(1220(15)24)1119(27)1326)3321(29)892825(31)3214176435717h37101219H89111314H212H3(H2831)
MFCD01554323
ZINC000002594499
ZINC000002594500
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