Vitas-M small molecule compound
Nalpha-(tert-butoxycarbonyl)-N-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)-1-methyl-L-tryptophanamide
Catalog ID
STL547636
SMILES O=C(OC(C)(C)C)N[C@H](C(=O)NCC1COc2c(O1)cccc2)Cc1cn(c2c1cccc2)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 C26H31N3O5 MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O5/c1-26(2,3)34-25(31)28-20(13-17-15-29(4)21-10-6-5-9-19(17)21)24(30)27-14-18-16-32-22-11-7-8-12-23(22)33-18/h5-12,15,18,20H,13-14,16H2,1-4H3,(H,27,30)(H,28,31)/t18?,20-/m0/s1InChIKey
OYEPFCOWMNVWLY-IJHRGXPZSA-NSynonyms
~(tert)butyl~(N)((2~(S))1(23dihydro14benzodioxin3ylmethylamino)3(1methylindol3yl)1oxopropan2yl)carbamate
121541804
InChI=1SC26H31N3O5c126(23)3425(31)2820(13171529(4)211065919(17)21)24(30)27141816322211781223(22)3318h512151820H131416H214H3(H2730)(H2831)t18?20m0s1
Nalpha(tertbutoxycarbonyl)N(23dihydro14benzodioxin2ylmethyl)1methylLtryptophanamide
O=C(OC(C)(C)C)N(C@H)(C(=O)NCC1COc2c(O1)cccc2)Cc1cn(c2c1cccc2)C
tertbutyl((2S)1(((23dihydrobenzo(b)(14)dioxin2yl)methyl)amino)3(1methyl1Hindol3yl)1oxopropan2yl)carbamate
ZINC000263586013
ZINC000263586014
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