Vitas-M small molecule compound
methyl 4-{3-acetyl-4-hydroxy-1-[2-(5-methoxy-1H-indol-3-yl)ethyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate
Catalog ID
STK662137
SMILES COc1ccc2c(c1)c(CCN1C(=O)C(=C(C1c1ccc(cc1)C(=O)OC)C(=O)C)O)c[nH]2
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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 C25H24N2O6 MW 448.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O6/c1-14(28)21-22(15-4-6-16(7-5-15)25(31)33-3)27(24(30)23(21)29)11-10-17-13-26-20-9-8-18(32-2)12-19(17)20/h4-9,12-13,22,26,29H,10-11H2,1-3H3InChIKey
ZMWXNHXZFYDPSZ-UHFFFAOYSA-NSynonyms
919017-25-7919017257
CC(=O)C1=C(C(=O)N(C1C2=CC=C(C=C2)C(=O)OC)CCC3=CNC4=C3C=C(C=C4)OC)O
COc1ccc2c(c1)c(CCN1C(=O)C(=C(C1c1ccc(cc1)C(=O)OC)C(=O)C)O)c(nH)2
InChI=1SC25H24N2O6c114(28)2122(154616(7515)25(31)333)27(24(30)23(21)29)1110171326209818(322)1219(17)20h491213222629H1011H213H3
METHYL4(3ACETYL4HYDROXY1(2(5METHOXY1HINDOL3YL)ETHYL)5OXO25DIHYDRO1HPYRROL2YL)BENZOATE
methyl4(3acetyl4hydroxy1(2(5methoxy1Hindol3yl)ethyl)5oxo2Hpyrrol2yl)benzoate
MFCD09039792
ZINC000013533822
ZINC000013533826
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