Vitas-M small molecule compound
4-{1-[3-hydroxy-6-(methoxymethyl)-4-oxo-4H-pyran-2-yl]-3-oxo-3-(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)propyl}benzoic acid
Catalog ID
STL544216
SMILES COCc1cc(=O)c(c(o1)C(c1ccc(cc1)C(=O)O)CC(=O)N1CCc2c(C1)[nH]c1c2cccc1)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 C28H26N2O7 MW 502.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O7/c1-36-15-18-12-24(31)26(33)27(37-18)21(16-6-8-17(9-7-16)28(34)35)13-25(32)30-11-10-20-19-4-2-3-5-22(19)29-23(20)14-30/h2-9,12,21,29,33H,10-11,13-15H2,1H3,(H,34,35)InChIKey
LCQDMKGXAORGMQ-UHFFFAOYSA-NSynonyms
1630873-71-01630873710
4(1(3hydroxy6(methoxymethyl)4oxo4Hpyran2yl)3oxo3(1349tetrahydro2Hbetacarbolin2yl)propyl)benzoicacid
4(1(3hydroxy6(methoxymethyl)4oxopyran2yl)3oxo3(1349tetrahydropyrido(34b)indol2yl)propyl)benzoicacid
4(3(34DIHYDRO1HPYRIDO(34B)INDOL2(9H)YL)1(3HYDROXY6(METHOXYMETHYL)4OXO4HPYRAN2YL)3OXOPROPYL)BENZOICACID
91638571
COCc1cc(=O)c(c(o1)C(c1ccc(cc1)C(=O)O)CC(=O)N1CCc2c(C1)(nH)c1c2cccc1)O
InChI=1SC28H26N2O7c13615181224(31)26(33)27(3718)21(166817(9716)28(34)35)1325(32)3011102019423522(19)2923(20)1430h2912212933H10111315H21H3(H3435)
MFCD28350092
ZINC000217914896
ZINC000217914989
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