Vitas-M small molecule compound
[4-(tert-butoxycarbonyl)piperazin-1-yl][1-(carboxymethyl)-1H-indol-3-yl]acetic acid
Catalog ID
STK932725
SMILES OC(=O)Cn1cc(c2c1cccc2)C(N1CCN(CC1)C(=O)OC(C)(C)C)C(=O)O
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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 C21H27N3O6 MW 417.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O6/c1-21(2,3)30-20(29)23-10-8-22(9-11-23)18(19(27)28)15-12-24(13-17(25)26)16-7-5-4-6-14(15)16/h4-7,12,18H,8-11,13H2,1-3H3,(H,25,26)(H,27,28)InChIKey
XFRJSUWKTPUSQU-UHFFFAOYSA-NSynonyms
1214820-23-1(4(tertbutoxycarbonyl)piperazin1yl)(1(carboxymethyl)1Hindol3yl)aceticacid
1214820231
2(1(carboxymethyl)indol3yl)2(4((2methylpropan2yl)oxycarbonyl)piperazin1yl)aceticacid
2(4(tertbutoxycarbonyl)piperazin1yl)2(1(carboxymethyl)1Hindol3yl)aceticacid
CC(C)(C)OC(=O)N1CCN(CC1)C(C2=CN(C3=CC=CC=C32)CC(=O)O)C(=O)O
InChI=1SC21H27N3O6c121(23)3020(29)2310822(91123)18(19(27)28)151224(1317(25)26)16754614(15)16h471218H81113H213H3(H2526)(H2728)
MFCD13755437
ZINC000036352552
ZINC000036352554
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