Vitas-M small molecule compound
3-hydroxy-2-{1-[3-methoxy-4-(2-methylpropoxy)phenyl]-3-oxo-3-(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)propyl}-6-methyl-4H-pyran-4-one
Catalog ID
STL544177
SMILES COc1cc(ccc1OCC(C)C)C(c1oc(C)cc(=O)c1O)CC(=O)N1CCc2c(C1)[nH]c1c2cccc1
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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 C31H34N2O6 MW 530.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34N2O6/c1-18(2)17-38-27-10-9-20(14-28(27)37-4)23(31-30(36)26(34)13-19(3)39-31)15-29(35)33-12-11-22-21-7-5-6-8-24(21)32-25(22)16-33/h5-10,13-14,18,23,32,36H,11-12,15-17H2,1-4H3InChIKey
ITPNLCQPVCXMQN-UHFFFAOYSA-NSynonyms
1630840-25-31630840253
2(3(34DIHYDRO1HPYRIDO(34B)INDOL2(9H)YL)1(4ISOBUTOXY3METHOXYPHENYL)3OXOPROPYL)3HYDROXY6METHYL4HPYRAN4ONE
3hydroxy2(1(3methoxy4(2methylpropoxy)phenyl)3oxo3(1349tetrahydro2Hbetacarbolin2yl)propyl)6methyl4Hpyran4one
3hydroxy2(1(3methoxy4(2methylpropoxy)phenyl)3oxo3(1349tetrahydropyrido(34b)indol2yl)propyl)6methylpyran4one
91636443
COc1cc(ccc1OCC(C)C)C(c1oc(C)cc(=O)c1O)CC(=O)N1CCc2c(C1)(nH)c1c2cccc1
InChI=1SC31H34N2O6c118(2)17382710920(1428(27)374)23(3130(36)26(34)1319(3)3931)1529(35)3312112221756824(21)3225(22)1633h510131418233236H11121517H214H3
MFCD28348710
ZINC000217592541
ZINC000217592617
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