Vitas-M small molecule compound

5-{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}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one

Catalog ID
STL548589
SMILES COCc1cc(=O)c(c(o1)C(c1ccc2c(c1)n(C)c(=O)n2C)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 C30H30N4O6 MW 542.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N4O6/c1-32-24-9-8-17(12-25(24)33(2)30(32)38)21(29-28(37)26(35)13-18(40-29)16-39-3)14-27(36)34-11-10-20-19-6-4-5-7-22(19)31-23(20)15-34/h4-9,12-13,21,31,37H,10-11,14-16H2,1-3H3
InChIKey
JDJOVIOAMAJERT-UHFFFAOYSA-N
Synonyms
1630831-62-7
1630831627
5(1(3hydroxy6(methoxymethyl)4oxo4Hpyran2yl)3oxo3(1349tetrahydro2Hbetacarbolin2yl)propyl)13dimethyl13dihydro2Hbenzimidazol2one
5(1(3hydroxy6(methoxymethyl)4oxopyran2yl)3oxo3(1349tetrahydropyrido(34b)indol2yl)propyl)13dimethylbenzimidazol2one
5(3(34DIHYDRO1HPYRIDO(34B)INDOL2(9H)YL)1(3HYDROXY6(METHOXYMETHYL)4OXO4HPYRAN2YL)3OXOPROPYL)13DIMETHYL1HBENZO(D)IMIDAZOL2(3H)ONE
91637879
COCc1cc(=O)c(c(o1)C(c1ccc2c(c1)n(C)c(=O)n2C)CC(=O)N1CCc2c(C1)(nH)c1c2cccc1)O
InChI=1SC30H30N4O6c132249817(1225(24)33(2)30(32)38)21(2928(37)26(35)1318(4029)16393)1427(36)3411102019645722(19)3123(20)1534h491213213137H10111416H213H3
MFCD28349650
ZINC000217814352
ZINC000217814430

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Available files

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