Vitas-M small molecule compound
N-{2-[(4-butyl-2-oxo-2H-chromen-7-yl)oxy]propanoyl}-L-tryptophan
Catalog ID
STL460698
SMILES CCCCc1cc(=O)oc2c1ccc(c2)OC(C(=O)N[C@H](C(=O)O)Cc1c[nH]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 C27H28N2O6 MW 476.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O6/c1-3-4-7-17-13-25(30)35-24-14-19(10-11-21(17)24)34-16(2)26(31)29-23(27(32)33)12-18-15-28-22-9-6-5-8-20(18)22/h5-6,8-11,13-16,23,28H,3-4,7,12H2,1-2H3,(H,29,31)(H,32,33)/t16?,23-/m0/s1InChIKey
CDZRYNQLEUMRFT-KESSSICBSA-NSynonyms
956822-59-6(2S)2(2((4butyl2oxo2Hchromen7yl)oxy)propanamido)3(1Hindol3yl)propanoicacid
(2S)2(2(4butyl2oxochromen7yl)oxypropanoylamino)3(1Hindol3yl)propanoicacid
956822596
CCCCC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O
CCCCc1cc(=O)oc2c1ccc(c2)OC(C(=O)N(C@H)(C(=O)O)Cc1c(nH)c2c1cccc2)C
InChI=1SC27H28N2O6c1347171325(30)35241419(101121(17)24)3416(2)26(31)2923(27(32)33)1218152822965820(18)22h5681113162328H34712H212H3(H2931)(H3233)t16?23m0s1
N(2((4butyl2oxo2Hchromen7yl)oxy)propanoyl)Ltryptophan
ZINC000002108225
ZINC000002108227
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