Vitas-M small molecule compound
4-methyl-2-oxo-3-propyl-2H-chromen-7-yl N-(tert-butoxycarbonyl)-beta-alaninate
Catalog ID
STL460222
SMILES CCCc1c(=O)oc2c(c1C)ccc(c2)OC(=O)CCNC(=O)OC(C)(C)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 C21H27NO6 MW 389.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27NO6/c1-6-7-16-13(2)15-9-8-14(12-17(15)27-19(16)24)26-18(23)10-11-22-20(25)28-21(3,4)5/h8-9,12H,6-7,10-11H2,1-5H3,(H,22,25)InChIKey
UQSKGVZIVHAJCY-UHFFFAOYSA-NSynonyms
374701-23-2(4METHYL2OXO3PROPYLCHROMEN7YL)3((2METHYLPROPAN2YL)OXYCARBONYLAMINO)PROPANOATE
374701232
4methyl2oxo3propyl2Hchromen7yl3((tertbutoxycarbonyl)amino)propanoate
4methyl2oxo3propyl2Hchromen7ylN(tertbutoxycarbonyl)betaalaninate
CCCC1=C(C2=C(C=C(C=C2)OC(=O)CCNC(=O)OC(C)(C)C)OC1=O)C
InChI=1SC21H27NO6c1671613(2)159814(1217(15)2719(16)24)2618(23)10112220(25)2821(34)5h8912H671011H215H3(H2225)
MFCD01544790
ZINC000004024491
ZINC04024491
ZINC4024491
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