Vitas-M small molecule compound
3-hexyl-7-hydroxy-4-methyl-8-({methyl[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]amino}methyl)-2H-chromen-2-one
Catalog ID
STL578497
SMILES CCCCCCc1c(=O)oc2c(c1C)ccc(c2CN(C[C@@H]1CCCN2[C@@H]1CCCC2)C)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 C28H42N2O3 MW 454.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H42N2O3/c1-4-5-6-7-12-23-20(2)22-14-15-26(31)24(27(22)33-28(23)32)19-29(3)18-21-11-10-17-30-16-9-8-13-25(21)30/h14-15,21,25,31H,4-13,16-19H2,1-3H3/t21-,25+/m0/s1InChIKey
IZHNABCXIAWUAP-SQJMNOBHSA-NSynonyms
3hexyl7hydroxy4methyl8((methyl(((1S9aR)octahydro1Hquinolizin1yl)methyl)amino)methyl)2Hchromen2one
3hexyl7hydroxy4methyl8((methyl((1S9aR)octahydro2Hquinolizin1ylmethyl)amino)methyl)2Hchromen2one
CCCCCCc1c(=O)oc2c(c1C)ccc(c2CN(C(C@@H)1CCCN2(C@@H)1CCCC2)C)O
InChI=1SC28H42N2O3c14567122320(2)22141526(31)24(27(22)3328(23)32)1929(3)18211110173016981325(21)30h1415212531H4131619H213H3t2125+m0s1
MFCD33396977
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