Vitas-M small molecule compound
[1-(carboxymethyl)-1H-indol-3-yl]{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}acetic acid
Catalog ID
STK935922
SMILES OC(=O)Cn1cc(c2c1cccc2)C(N1CCN(CC1)C/C=C/c1ccccc1)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 C25H27N3O4 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4/c29-23(30)18-28-17-21(20-10-4-5-11-22(20)28)24(25(31)32)27-15-13-26(14-16-27)12-6-9-19-7-2-1-3-8-19/h1-11,17,24H,12-16,18H2,(H,29,30)(H,31,32)/b9-6+InChIKey
IAHWRGHOUDXRSI-RMKNXTFCSA-NSynonyms
(1(carboxymethyl)1Hindol3yl)(4((2E)3phenylprop2en1yl)piperazin1yl)aceticacid
(E)2(1(carboxymethyl)1Hindol3yl)2(4cinnamylpiperazin1yl)aceticacid
2(1(carboxymethyl)indol3yl)2(4((E)3phenylprop2enyl)piperazin1yl)aceticacid
C1CN(CCN1CC=CC2=CC=CC=C2)C(C3=CN(C4=CC=CC=C43)CC(=O)O)C(=O)O
InChI=1SC25H27N3O4c2923(30)18281721(2010451122(20)28)24(25(31)32)27151326(141627)1269197213819h1111724H121618H2(H2930)(H3132)b96+
MFCD13755553
OC(=O)Cn1cc(c2c1cccc2)C(N1CCN(CC1)CC=Cc1ccccc1)C(=O)O
ZINC000036352773
ZINC000036352775
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