Vitas-M small molecule compound
3-hydroxy-2-[1-(4-hydroxy-3,5-dimethoxyphenyl)-3-oxo-3-(1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl)propyl]-6-(methoxymethyl)-4H-pyran-4-one
Catalog ID
STL545219
SMILES COCc1cc(=O)c(c(o1)C(c1cc(OC)c(c(c1)OC)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 C29H30N2O8 MW 534.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O8/c1-36-15-17-12-23(32)27(34)29(39-17)20(16-10-24(37-2)28(35)25(11-16)38-3)13-26(33)31-9-8-19-18-6-4-5-7-21(18)30-22(19)14-31/h4-7,10-12,20,30,34-35H,8-9,13-15H2,1-3H3InChIKey
KIDQQYBUFDFBAY-UHFFFAOYSA-NSynonyms
1630831-78-51630831785
2(3(34DIHYDRO1HPYRIDO(34B)INDOL2(9H)YL)1(4HYDROXY35DIMETHOXYPHENYL)3OXOPROPYL)3HYDROXY6(METHOXYMETHYL)4HPYRAN4ONE
3hydroxy2(1(4hydroxy35dimethoxyphenyl)3oxo3(1349tetrahydro2Hbetacarbolin2yl)propyl)6(methoxymethyl)4Hpyran4one
3hydroxy2(1(4hydroxy35dimethoxyphenyl)3oxo3(1349tetrahydropyrido(34b)indol2yl)propyl)6(methoxymethyl)pyran4one
91637640
COCc1cc(=O)c(c(o1)C(c1cc(OC)c(c(c1)OC)O)CC(=O)N1CCc2c(C1)(nH)c1c2cccc1)O
InChI=1SC29H30N2O8c13615171223(32)27(34)29(3917)20(161024(372)28(35)25(1116)383)1326(33)31981918645721(18)3022(19)1431h47101220303435H891315H213H3
MFCD28349497
ZINC000217778550
ZINC000217778618
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