Vitas-M small molecule compound

3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl N-(tert-butoxycarbonyl)-L-phenylalaninate

Catalog ID
STK991648
SMILES Cc1cc(OC(=O)[C@@H](NC(=O)OC(C)(C)C)Cc2ccccc2)c2c(c1)oc(=O)c(c2C)Cc1ccccc1

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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 C32H33NO6 MW 527.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33NO6/c1-20-16-26-28(21(2)24(29(34)37-26)18-22-12-8-6-9-13-22)27(17-20)38-30(35)25(19-23-14-10-7-11-15-23)33-31(36)39-32(3,4)5/h6-17,25H,18-19H2,1-5H3,(H,33,36)/t25-/m0/s1
InChIKey
BFZOQUPNYUGPPQ-VWLOTQADSA-N
Synonyms
956385-12-9
(3BENZYL47DIMETHYL2OXOCHROMEN5YL)(2S)2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)3PHENYLPROPANOATE
(S)3benzyl47dimethyl2oxo2Hchromen5yl2((tertbutoxycarbonyl)amino)3phenylpropanoate
3benzyl47dimethyl2oxo2Hchromen5ylN(tertbutoxycarbonyl)Lphenylalaninate
956385129
CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OC(=O)C(CC4=CC=CC=C4)NC(=O)OC(C)(C)C
Cc1cc(OC(=O)(C@@H)(NC(=O)OC(C)(C)C)Cc2ccccc2)c2c(c1)oc(=O)c(c2C)Cc1ccccc1
InChI=1SC32H33NO6c120162628(21(2)24(29(34)3726)1822128691322)27(1720)3830(35)25(192314107111523)3331(36)3932(34)5h61725H1819H215H3(H3336)t25m0s1
ZINC000002092191
ZINC02092191
ZINC2092191

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Available files

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