Vitas-M small molecule compound

3-[4-(methoxycarbonyl)phenoxy]-4-oxo-4H-chromen-7-yl N-(tert-butoxycarbonyl)-L-tryptophanate

Catalog ID
STL464783
SMILES COC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OC(=O)[C@H](Cc1c[nH]c2c1cccc2)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 C33H30N2O9 MW 598.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30N2O9/c1-33(2,3)44-32(39)35-26(15-20-17-34-25-8-6-5-7-23(20)25)31(38)43-22-13-14-24-27(16-22)41-18-28(29(24)36)42-21-11-9-19(10-12-21)30(37)40-4/h5-14,16-18,26,34H,15H2,1-4H3,(H,35,39)/t26-/m0/s1
InChIKey
IHTNDYJRDXZPEI-SANMLTNESA-N
Synonyms
298206-71-0
(S)methyl4((7((2((tertbutoxycarbonyl)amino)3(1Hindol3yl)propanoyl)oxy)4oxo4Hchromen3yl)oxy)benzoate
298206710
3(4(methoxycarbonyl)phenoxy)4oxo4Hchromen7ylN(tertbutoxycarbonyl)Ltryptophanate
CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC3=CC4=C(C=C3)C(=O)C(=CO4)OC5=CC=C(C=C5)C(=O)OC
COC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OC(=O)(C@H)(Cc1c(nH)c2c1cccc2)NC(=O)OC(C)(C)C
InChI=1SC33H30N2O9c133(23)4432(39)3526(1520173425865723(20)25)31(38)432213142427(1622)411828(29(24)36)422111919(101221)30(37)404h51416182634H15H214H3(H3539)t26m0s1
methyl4(7((2S)3(1Hindol3yl)2((2methylpropan2yl)oxycarbonylamino)propanoyl)oxy4oxochromen3yl)oxybenzoate
MFCD06438992
ZINC000070665320
ZINC70665320

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Available files

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