Vitas-M small molecule compound
3-benzyl-7-hydroxy-8-({(3-methoxypropyl)[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]amino}methyl)-4-methyl-2H-chromen-2-one
Catalog ID
STL579255
SMILES COCCCN(Cc1c(O)ccc2c1oc(=O)c(c2C)Cc1ccccc1)C[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 C32H42N2O4 MW 518.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H42N2O4/c1-23-26-14-15-30(35)28(31(26)38-32(36)27(23)20-24-10-4-3-5-11-24)22-33(16-9-19-37-2)21-25-12-8-18-34-17-7-6-13-29(25)34/h3-5,10-11,14-15,25,29,35H,6-9,12-13,16-22H2,1-2H3/t25-,29+/m0/s1InChIKey
VQQKTHAQJRMBKX-ABYGYWHVSA-NSynonyms
3benzyl7hydroxy8(((3methoxypropyl)(((1S9aR)octahydro1Hquinolizin1yl)methyl)amino)methyl)4methyl2Hchromen2one
3benzyl7hydroxy8(((3methoxypropyl)((1S9aR)octahydro2Hquinolizin1ylmethyl)amino)methyl)4methyl2Hchromen2one
COCCCN(Cc1c(O)ccc2c1oc(=O)c(c2C)Cc1ccccc1)C(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC32H42N2O4c12326141530(35)28(31(26)3832(36)27(23)2024104351124)2233(16919372)2125128183417761329(25)34h3510111415252935H6912131622H212H3t2529+m0s1
MFCD33397587
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