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Vitas-M small molecule compound

3-[4-(methoxycarbonyl)phenoxy]-2-methyl-4-oxo-4H-chromen-7-yl O-benzyl-N-(tert-butoxycarbonyl)tyrosinate

Catalog ID
STL525843
SMILES COC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)OC(=O)C(Cc1ccc(cc1)OCc1ccccc1)NC(=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 C39H37NO10 MW 679.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H37NO10/c1-24-35(48-29-17-13-27(14-18-29)36(42)45-5)34(41)31-20-19-30(22-33(31)47-24)49-37(43)32(40-38(44)50-39(2,3)4)21-25-11-15-28(16-12-25)46-23-26-9-7-6-8-10-26/h6-20,22,32H,21,23H2,1-5H3,(H,40,44)
InChIKey
XEFVNTPBZZZFEE-UHFFFAOYSA-N
Synonyms

(S)methyl4((7((3(4(benzyloxy)phenyl)2((tertbutoxycarbonyl)amino)propanoyl)oxy)2methyl4oxo4Hchromen3yl)oxy)benzoate
3(4(methoxycarbonyl)phenoxy)2methyl4oxo4Hchromen7ylObenzylN(tertbutoxycarbonyl)tyrosinate
3798134
COC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2)OC(=O)(C@H)(Cc1ccc(cc1)OCc1ccccc1)NC(=O)OC(C)(C)C
InChI=1SC39H37NO10c12435(4829171327(141829)36(42)455)34(41)31201930(2233(31)4724)4937(43)32(4038(44)5039(23)4)2125111528(161225)46232697681026h6202232H2123H215H3(H4044)
METHYL4((7((3(4(BENZYLOXY)PHENYL)2((TERTBUTOXYCARBONYL)AMINO)PROPANOYL)OXY)2METHYL4OXO4HCHROMEN3YL)OXY)BENZOATE
METHYL4(2METHYL7(2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)3(4PHENYLMETHOXYPHENYL)PROPANOYL)OXY4OXOCHROMEN3YL)OXYBENZOATE
MFCD00583968
ZINC000085867854
ZINC000085867859

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Available files

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