Vitas-M small molecule compound
N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]-3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanamide
Catalog ID
STL539366
SMILES O=C(CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1c1ccccc1)C)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 C33H38N2O4 MW 526.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H38N2O4/c1-20-25(14-15-29(36)34-19-24-12-9-17-35-16-8-7-13-28(24)35)33(37)39-31-21(2)32-27(18-26(20)31)30(22(3)38-32)23-10-5-4-6-11-23/h4-6,10-11,18,24,28H,7-9,12-17,19H2,1-3H3,(H,34,36)/t24-,28+/m0/s1InChIKey
AOHBYGLKVBFOHN-RBJSKKJNSA-NSynonyms
~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)3(259trimethyl7oxo3phenylfuro(32g)chromen6yl)propanamide
71753977
InChI=1SC33H38N2O4c12025(141529(36)341924129173516871328(24)35)33(37)393121(2)3227(1826(20)31)30(22(3)3832)23105461123h461011182428H79121719H213H3(H3436)t2428+m0s1
N(((1S9aR)octahydro1Hquinolizin1yl)methyl)3(259trimethyl7oxo3phenyl7Hfuro(32g)chromen6yl)propanamide
N((1S9aR)octahydro2Hquinolizin1ylmethyl)3(259trimethyl7oxo3phenyl7Hfuro(32g)chromen6yl)propanamide
O=C(CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1c1ccccc1)C)NC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000079190716
ZINC79190716
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