Vitas-M small molecule compound
(1S,5S)-3-{[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL537011
SMILES O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1
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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 C28H24N2O6 MW 484.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O6/c31-22-10-20(11-25-28(22)23(32)12-24(36-25)18-5-2-1-3-6-18)35-16-27(34)29-13-17-9-19(15-29)21-7-4-8-26(33)30(21)14-17/h1-8,10-12,17,19,31H,9,13-16H2/t17-,19+/m0/s1InChIKey
OHIBGHJEBJGFLO-PKOBYXMFSA-NSynonyms
(1~(R)9~(S))11(2(5hydroxy4oxo2phenylchromen7yl)oxyacetyl)711diazatricyclo(7310^(27))trideca24dien6one
(1R5S)3(2((5hydroxy4oxo2phenyl4Hchromen7yl)oxy)acetyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5S)3(((5hydroxy4oxo2phenyl4Hchromen7yl)oxy)acetyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
44891386
InChI=1SC28H24N2O6c31221020(112528(22)23(32)1224(3625)185213618)351627(34)291317919(1529)2174826(33)30(21)1417h181012171931H91316H2t1719+m0s1
O=C(N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1
ZINC000015894229
ZINC15894229
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