Vitas-M small molecule compound
3-benzyl-7-hydroxy-6-({(3-methoxypropyl)[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]amino}methyl)-4,8-dimethyl-2H-chromen-2-one
Catalog ID
STL579207
SMILES COCCCN(Cc1cc2c(c(c1O)C)oc(=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 C33H44N2O4 MW 532.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H44N2O4/c1-23-28-20-27(31(36)24(2)32(28)39-33(37)29(23)19-25-11-5-4-6-12-25)22-34(15-10-18-38-3)21-26-13-9-17-35-16-8-7-14-30(26)35/h4-6,11-12,20,26,30,36H,7-10,13-19,21-22H2,1-3H3/t26-,30+/m0/s1InChIKey
OEOZUAHTYWQVCC-FREGXXQWSA-NSynonyms
3benzyl7hydroxy6(((3methoxypropyl)(((1S9aR)octahydro1Hquinolizin1yl)methyl)amino)methyl)48dimethyl2Hchromen2one
3benzyl7hydroxy6(((3methoxypropyl)((1S9aR)octahydro2Hquinolizin1ylmethyl)amino)methyl)48dimethyl2Hchromen2one
COCCCN(Cc1cc2c(c(c1O)C)oc(=O)c(c2C)Cc1ccccc1)C(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC33H44N2O4c123282027(31(36)24(2)32(28)3933(37)29(23)1925115461225)2234(151018383)2126139173516871430(26)35h46111220263036H71013192122H213H3t2630+m0s1
MFCD33397549
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