Vitas-M small molecule compound

3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl N-(tert-butoxycarbonyl)-L-tryptophanate

Catalog ID
STL462362
SMILES O=C(OC(C)(C)C)N[C@H](C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)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 C34H34N2O6 MW 566.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H34N2O6/c1-20-24-15-16-29(21(2)30(24)41-31(37)26(20)17-22-11-7-6-8-12-22)40-32(38)28(36-33(39)42-34(3,4)5)18-23-19-35-27-14-10-9-13-25(23)27/h6-16,19,28,35H,17-18H2,1-5H3,(H,36,39)/t28-/m0/s1
InChIKey
AUOWHRTVYOLYDW-NDEPHWFRSA-N
Synonyms
956962-40-6
(3BENZYL48DIMETHYL2OXOCHROMEN7YL)(2S)3(1HINDOL3YL)2((2METHYLPROPAN2YL)OXYCARBONYLAMINO)PROPANOATE
(S)3benzyl48dimethyl2oxo2Hchromen7yl2((tertbutoxycarbonyl)amino)3(1Hindol3yl)propanoate
3benzyl48dimethyl2oxo2Hchromen7ylN(tertbutoxycarbonyl)Ltryptophanate
956962406
CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)OC(C)(C)C)CC5=CC=CC=C5
InChI=1SC34H34N2O6c12024151629(21(2)30(24)4131(37)26(20)1722117681222)4032(38)28(3633(39)4234(34)5)1823193527141091325(23)27h616192835H1718H215H3(H3639)t28m0s1
O=C(OC(C)(C)C)N(C@H)(C(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)Cc1c(nH)c2c1cccc2
ZINC000002094100
ZINC2094100

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Available files

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