Vitas-M small molecule compound

3,4,8-trimethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)-D-tryptophanate

Catalog ID
STL530017
SMILES O=C(OC(C)(C)C)N[C@@H](C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)C)Cc1c[nH]c2c1cccc2

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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 C28H30N2O6 MW 490.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O6/c1-15-16(2)25(31)35-24-17(3)23(12-11-19(15)24)34-26(32)22(30-27(33)36-28(4,5)6)13-18-14-29-21-10-8-7-9-20(18)21/h7-12,14,22,29H,13H2,1-6H3,(H,30,33)/t22-/m1/s1
InChIKey
BUUXHRZWJCYZMA-JOCHJYFZSA-N
Synonyms

(348trimethyl2oxochromen7yl)(2~(R))3(1~(H)indol3yl)2((2methylpropan2yl)oxycarbonylamino)propanoate
(S)348trimethyl2oxo2Hchromen7yl2((tertbutoxycarbonyl)amino)3(1Hindol3yl)propanoate
348trimethyl2oxo2Hchromen7ylN(tertbutoxycarbonyl)Dtryptophanate
6568625
InChI=1SC28H30N2O6c11516(2)25(31)352417(3)23(121119(15)24)3426(32)22(3027(33)3628(45)6)13181429211087920(18)21h712142229H13H216H3(H3033)t22m1s1
O=C(OC(C)(C)C)N(C@H)(C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)C)Cc1c(nH)c2c1cccc2
ZINC000016042839

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Available files

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