Vitas-M small molecule compound
3-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]propanamide
Catalog ID
STL550940
SMILES COc1cc(ccc1O)C(c1oc(C)cc(=O)c1O)CC(=O)NC[C@@H]1CCCN2[C@@H]1CCCC2
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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 C26H34N2O6 MW 470.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N2O6/c1-16-12-22(30)25(32)26(34-16)19(17-8-9-21(29)23(13-17)33-2)14-24(31)27-15-18-6-5-11-28-10-4-3-7-20(18)28/h8-9,12-13,18-20,29,32H,3-7,10-11,14-15H2,1-2H3,(H,27,31)/t18-,19?,20+/m0/s1InChIKey
ZCARHZXAKYHRKA-SJBAFXMYSA-NSynonyms
~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxopyran2yl)propanamide
127252648
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)propanamide
3(4hydroxy3methoxyphenyl)3(3hydroxy6methyl4oxo4Hpyran2yl)N((1S9aR)octahydro2Hquinolizin1ylmethyl)propanamide
COc1cc(ccc1O)C(c1oc(C)cc(=O)c1O)CC(=O)NC(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC26H34N2O6c1161222(30)25(32)26(3416)19(178921(29)23(1317)332)1424(31)2715186511281043720(18)28h89121318202932H3710111415H212H3(H2731)t1819?20+m0s1
ZINC000604406038
ZINC000604406040
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