Vitas-M small molecule compound
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-Nalpha-[(4-methylcyclohexyl)carbonyl]tryptophanamide
Catalog ID
STK248818
SMILES CC1CCC(CC1)C(=O)NC(C(=O)Nc1ccc2c(c1)OCCO2)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 C27H31N3O4 MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O4/c1-17-6-8-18(9-7-17)26(31)30-23(14-19-16-28-22-5-3-2-4-21(19)22)27(32)29-20-10-11-24-25(15-20)34-13-12-33-24/h2-5,10-11,15-18,23,28H,6-9,12-14H2,1H3,(H,29,32)(H,30,31)InChIKey
VGUMCFDRVDCUDN-UHFFFAOYSA-NSynonyms
CC1CCC(CC1)C(=O)NC(C(=O)Nc1ccc2c(c1)OCCO2)Cc1c(nH)c2c1cccc2
CC1CCC(CC1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NC4=CC5=C(C=C4)OCCO5
InChI=1SC27H31N3O4c1176818(9717)26(31)3023(1419162822532421(19)22)27(32)292010112425(1520)3413123324h25101115182328H691214H21H3(H2932)(H3031)
MFCD08685582
N(1(23dihydro14benzodioxin6ylamino)3(1Hindol3yl)1oxopropan2yl)4methylcyclohexane1carboxamide
N(23dihydro14benzodioxin6yl)Nalpha((4methylcyclohexyl)carbonyl)tryptophanamide
ZINC000009668176
ZINC000009668177
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